Showing entry for Retinol


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0047568
Compound NameRetinol
Structure
FormulaC20H30O
InchiKeyFPIPGXGPPPQFEQ-OVSJKPMPSA-N
SMILESOC/C=C(/C=C/C=C(/C=C/C1=C(C)CCCC1(C)C)\C)\C
InchiInChI=1S/C20H30O/c1-16(8-6-9-17(2)13-15-21)11-12-19-18(3)10-7-14-20(19,4)5/h6,8-9,11-13,21H,7,10,14-15H2,1-5H3/b9-6+,12-11+,16-8+,17-13+
IUPAC(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraen-1-ol
Molecular Weight286.23
Pubchem Id445354
Chembl IdCHEMBL986
Targets of Information Source
DrugBank DB00162
Uniport Id BXGT Id Protein Name Status Protein Class Gene Groups Target Type
Uniport Id BXGT Id Protein Name Status Protein Class Gene Groups Target Type
Q96NR8 BXGT019701 Retinol dehydrogenase 12 reviewed Enzyme RDH12 approved; nutraceutical; vet_approved substrate
O75911 BXGT005164 Short-chain dehydrogenase/reductase 3 reviewed - DHRS3 approved; nutraceutical; vet_approved substrate
P47895 BXGT010593 Aldehyde dehydrogenase family 1 member A3 reviewed Enzyme ALDH1A3 approved; nutraceutical; vet_approved substrate
Q6NUM9 BXGT016430 All-trans-retinol 13,14-reductase reviewed - RETSAT approved; nutraceutical; vet_approved substrate
Q8TC12 BXGT018793 Retinol dehydrogenase 11 reviewed Enzyme RDH11 approved; nutraceutical; vet_approved substrate
Q9BTZ2 BXGT020129 Dehydrogenase/reductase SDR family member 4 reviewed - DHRS4 approved; nutraceutical; vet_approved substrate
Q9HBH5 BXGT020520 Retinol dehydrogenase 14 reviewed Enzyme RDH14 approved; nutraceutical; vet_approved substrate
Q9NYR8 BXGT021261 Retinol dehydrogenase 8 reviewed Enzyme RDH8 approved; nutraceutical; vet_approved substrate
O95237 BXGT005361 Lecithin retinol acyltransferase reviewed - LRAT approved; nutraceutical; vet_approved substrate
Q92781 BXGT019372 Retinol dehydrogenase 5 reviewed Enzyme RDH5 approved; nutraceutical; vet_approved substrate
Q8NBN7 BXGT018540 Retinol dehydrogenase 13 reviewed - RDH13 approved; nutraceutical; vet_approved substrate
O94788 BXGT005333 Retinal dehydrogenase 2 reviewed Enzyme ALDH1A2 approved; nutraceutical; vet_approved substrate
P00352 BXGT005510 Retinal dehydrogenase 1 reviewed Enzyme ALDH1A1 approved; nutraceutical; vet_approved substrate
P05090 BXGT006311 Apolipoprotein D reviewed - APOD approved; nutraceutical; vet_approved ligand
P41222 BXGT010237 Prostaglandin-H2 D-isomerase reviewed Enzyme PTGDS approved; nutraceutical; vet_approved ligand
PDB RTL
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM Ka M-1
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM Ka M-1
P27485 BXGT009186 Retinol-binding protein 4 reviewed RBP4 - - - - -
P02753 BXGT005945 Retinol-binding protein 4 reviewed RBP4 Transporter - - - -
P02696 BXGT005923 Retinol-binding protein 1 reviewed Rbp1 - - - - -
P06768 BXGT006503 Retinol-binding protein 2 reviewed Rbp2 - - - - -
P35444 BXGT009833 Cartilage oligomeric matrix protein reviewed Comp - - - - -
Q26490 BXGT013916 Retinol dehydratase unreviewed - - - - -
P02754 BXGT005946 Beta-lactoglobulin reviewed LGB - - - - -
P18902 BXGT008441 Retinol-binding protein 4 reviewed RBP4 - - - - -
P41263 BXGT010249 Retinol-binding protein 4 reviewed RBP4 - - - - -
Q8UVG6 BXGT018905 Cellular retinol-binding protein type II unreviewed rbp2a - - - - -
P02753 BXGT005945 Retinol-binding protein 4 reviewed RBP4 Transporter 190 - - -
P50120 BXGT010773 Retinol-binding protein 2 reviewed RBP2 - - - - -
P50120 BXGT010773 Retinol-binding protein 2 reviewed RBP2 - - - 2 -
P09455 BXGT006890 Retinol-binding protein 1 reviewed RBP1 - - - 18.5 -
P09455 BXGT006890 Retinol-binding protein 1 reviewed RBP1 - - - 4.5 -
P09455 BXGT006890 Retinol-binding protein 1 reviewed RBP1 - - - 65 -
P09455 BXGT006890 Retinol-binding protein 1 reviewed RBP1 - - - 70 -
P09455 BXGT006890 Retinol-binding protein 1 reviewed RBP1 - - - 250 -
P04918 BXGT025275 Serum amyloid A-3 protein reviewed Saa3 - - - - -
Binding DB 50092056
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM EC50 nM
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM EC50 nM
reviewed BXGT005946 Beta-lactoglobulin reviewed LGB - - 36 -
CHEMBL CHEMBL986
Uniport Id BXGT Id Protein Name Status Protein Class Gene width="10%">Type Relation value Units
Uniport Id BXGT Id Protein Name Status Protein Class Gene Type Relation value Units
O75604 BXGT005139 Ubiquitin carboxyl-terminal hydrolase 2 reviewed Enzyme USP2 Potency '=' 10000 nM
Q9F4F7 BXGT020344 4'-phosphopantetheinyl transferase ffp reviewed - ffp Potency '=' 63095 nM
P22310 BXGT008754 UDP-glucuronosyltransferase 1-4 reviewed - UGT1A4 Activity '=' 0 pm/min/mg
O94782 BXGT005332 Ubiquitin carboxyl-terminal hydrolase 1 reviewed Enzyme USP1 Potency - 79432 nM
Q12809 BXGT013267 Potassium voltage-gated channel subfamily H member 2 reviewed Ion channel KCNH2 Potency - 14125 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 33498 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 23109 nM
P37231 BXGT009972 Peroxisome proliferator-activated receptor gamma reviewed Nuclear receptor PPARG Potency - 44668 nM
P25779 BXGT009067 Cruzipain reviewed - Potency '=' 39810 nM
P00352 BXGT005510 Retinal dehydrogenase 1 reviewed Enzyme ALDH1A1 Potency '=' 25118 nM
O75496 BXGT005132 Geminin reviewed - GMNN Potency - 33498 nM
Q9NPD5 BXGT021151 Solute carrier organic anion transporter family member 1B3 reviewed Transporter SLCO1B3 Inhibition '=' 31 %
P04150 BXGT006154 Glucocorticoid receptor reviewed Nuclear receptor NR3C1 Potency - 44668 nM
P02769 BXGT005956 Serum albumin reviewed - ALB Activity '=' 18 %
P02769 BXGT005956 Serum albumin reviewed - ALB Activity '=' 14 %
P02769 BXGT005956 Serum albumin reviewed - ALB Activity '=' 20 %
P10636 BXGT007596 Microtubule-associated protein tau reviewed - MAPT Potency '=' 25118 nM
P00352 BXGT005510 Retinal dehydrogenase 1 reviewed Enzyme ALDH1A1 Potency '=' 28183 nM
P08684 BXGT006812 Cytochrome P450 3A4 reviewed Enzyme CYP3A4 Potency '=' 15848 nM
P21397 BXGT008644 Amine oxidase [flavin-containing] A reviewed - MAOA Activity - - -
P02769 BXGT005956 Serum albumin reviewed - ALB Activity '=' 10 %
P16473 BXGT008234 Thyrotropin receptor reviewed G-protein coupled receptor TSHR Potency '=' 39810 nM
P16050 BXGT008184 Arachidonate 15-lipoxygenase reviewed Enzyme ALOX15 Potency '=' 12589 nM
P10276 BXGT007553 Retinoic acid receptor alpha reviewed Nuclear receptor RARA Activity - - -
O89049 BXGT005293 Thioredoxin reductase 1, cytoplasmic reviewed - Txnrd1 Potency - 50118 nM
P02769 BXGT005956 Serum albumin reviewed - ALB Activity - - -
P51449 BXGT010846 Nuclear receptor ROR-gamma reviewed Nuclear receptor RORC Potency - 47307 nM
O75496 BXGT005132 Geminin reviewed - GMNN Potency - 29092 nM
Q9UNA4 BXGT021785 DNA polymerase iota reviewed - POLI Potency - 70794 nM
P02754 BXGT005946 Beta-lactoglobulin reviewed - LGB Activity '=' 7 %
P02769 BXGT005956 Serum albumin reviewed - ALB Kq '=' 4 10'13/M/sec
P10636 BXGT007596 Microtubule-associated protein tau reviewed - MAPT Potency '=' 22387 nM
P02754 BXGT005946 Beta-lactoglobulin reviewed - LGB Activity '=' 128 nm
P03372 BXGT006059 Estrogen receptor reviewed Nuclear receptor ESR1 Potency - 39810 nM
P02754 BXGT005946 Beta-lactoglobulin reviewed - LGB Kd '=' 36 nM
Q9R1A7 BXGT021413 Nuclear receptor subfamily 1 group I member 2 reviewed - Nr1i2 Potency - 35481 nM
Q9R1A7 BXGT021413 Nuclear receptor subfamily 1 group I member 2 reviewed - Nr1i2 Potency - 44668 nM
P02753 BXGT005945 Retinol-binding protein 4 reviewed Transporter RBP4 Kd '=' 182 nM
P27338 BXGT009172 Amine oxidase [flavin-containing] B reviewed - MAOB Activity - - -
Q03181 BXGT012701 Peroxisome proliferator-activated receptor delta reviewed Nuclear receptor PPARD Potency - 50118 nM
P00352 BXGT005510 Retinal dehydrogenase 1 reviewed Enzyme ALDH1A1 Potency '=' 5967 nM
P51450 BXGT010847 Nuclear receptor ROR-gamma reviewed - Rorc Potency '=' 14125 nM
P28482 BXGT009263 Mitogen-activated protein kinase 1 reviewed Kinase MAPK1 Potency '=' 31 nM
P04150 BXGT006154 Glucocorticoid receptor reviewed Nuclear receptor NR3C1 Potency - 3 nM
P10145 BXGT007542 Interleukin-8 reviewed Signaling CXCL8 Potency - 37578 nM
P19793 BXGT008515 Retinoic acid receptor RXR-alpha reviewed Nuclear receptor RXRA Potency - 3 nM
Q16236 BXGT013624 Nuclear factor erythroid 2-related factor 2 reviewed Enzyme NFE2L2 Potency - 42163 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 20596 nM
P03372 BXGT006059 Estrogen receptor reviewed Nuclear receptor ESR1 Potency - 3162 nM
P02769 BXGT005956 Serum albumin reviewed - ALB K '=' 5 10'6/M
P04150 BXGT006154 Glucocorticoid receptor reviewed Nuclear receptor NR3C1 Potency - 39810 nM
Q16236 BXGT013624 Nuclear factor erythroid 2-related factor 2 reviewed Enzyme NFE2L2 Potency - 47307 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 16360 nM
P11473 BXGT007709 Vitamin D3 receptor reviewed Nuclear receptor VDR Potency - 100000 nM
P25094 BXGT009014 Peripheral myelin protein 22 reviewed - Pmp22 Potency - 12817 nM
P02769 BXGT005956 Serum albumin reviewed - ALB Activity '=' 52 %
P02769 BXGT005956 Serum albumin reviewed - ALB Activity '=' 36 %
Q03431 BXGT012714 Parathyroid hormone/parathyroid hormone-related peptide receptor reviewed G-protein coupled receptor PTH1R Potency - 15848 nM
Q16236 BXGT013624 Nuclear factor erythroid 2-related factor 2 reviewed Enzyme NFE2L2 Potency - 68589 nM
Q03164 BXGT012700 Histone-lysine N-methyltransferase 2A reviewed - KMT2A Potency '=' 39810 nM
O00255 BXGT003903 Menin reviewed - MEN1 Potency '=' 39810 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 26608 nM
P02769 BXGT005956 Serum albumin reviewed - ALB Activity '=' 16 %
P02769 BXGT005956 Serum albumin reviewed - ALB Activity '=' 19 %
Q9Y6L6 BXGT022334 Solute carrier organic anion transporter family member 1B1 reviewed Transporter SLCO1B1 Inhibition '=' 18 %
P02769 BXGT005956 Serum albumin reviewed - ALB Activity '=' 15 %
Q16236 BXGT013624 Nuclear factor erythroid 2-related factor 2 reviewed Enzyme NFE2L2 Potency - 54482 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00181 Dandelion Taraxacum officinale Herbs and Spices
BXGF00200 Mung bean Vigna radiata Pulses
BXGF01019 Sinopodophyllum hexandrum Sinopodophyllum hexandrum Medicinal Plant
BXGF01065 Artemisia capillaris Artemisia capillaris Medicinal Plant
BXGF01104 Garcinia cambogia Garcinia cambogia Medicinal Plant
BXGF01252 Petasites laevigatus Petasites laevigatus Medicinal Plant
BXGF01404 Sphaeranthus confertifolius Sphaeranthus confertifolius Others
BXGF01426 Cornus officinalis Cornus officinalis Medicinal Plant
BXGF01556 Ornithoglossum viride Ornithoglossum viride Others
BXGF01606 Schizanthus tricolor Schizanthus tricolor Others
BXGF01631 Anodendron affine Anodendron affine Medicinal Plant
BXGF01669 Hertia cheirifolia Hertia cheirifolia Others
BXGF01720 Cedrela salvadorensis Cedrela salvadorensis Others
BXGF03249 Vitex trifolia Vitex trifolia Medicinal Plant
BXGF03255 Datura inoxia Datura inoxia Medicinal Plant
BXGF03735 Hansenia weberbaueriana Hansenia weberbaueriana Others
BXGF03902 Datura metel Datura metel Medicinal Plant
BXGF05436 Rubia tetragona Rubia tetragona Others
BXGF05858 Ormosia hosiei Ormosia hosiei Medicinal Plant
BXGF06250 Licaria chrysophylla Licaria chrysophylla Others
The  compound-realted  diseases
Diseases
BXGD Id Disease Name CUI Disease Id Disease Class Name Number of targets?Number of targets related to compound connecting disease, higher numbers indicate the compound is more associated with the disease