Showing entry for Tanshinone I


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0052948
Compound NameTanshinone I
Structure
FormulaC18H12O3
InchiKeyAIGAZQPHXLWMOJ-UHFFFAOYSA-N
SMILESCc1coc2c1C(=O)C(=O)c1c2ccc2c1cccc2C
InchiInChI=1S/C18H12O3/c1-9-4-3-5-12-11(9)6-7-13-15(12)17(20)16(19)14-10(2)8-21-18(13)14/h3-8H,1-2H3
IUPAC1,6-dimethylnaphtho[1,2-g][1]benzofuran-10,11-dione
Molecular Weight276.08
Pubchem Id114917
Chembl IdCHEMBL363535
Targets of Information Source
DrugBank n.a
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
PDB n.a
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
Binding DB 51317
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 BXGT012884 DNA repair protein RAD51 homolog 1 reviewed RAD51 - 85000 - -
reviewed BXGT007576 Streptokinase A reviewed ska - - - 150000
reviewed BXGT013612 Histone-lysine N-methyltransferase EZH2 reviewed Epigenetic regulator EZH2 - 8900 - -
reviewed BXGT007435 Replicase polyprotein 1a reviewed 1a 13700 - - -
reviewed BXGT007435 Replicase polyprotein 1a reviewed 1a - 38700 - -
reviewed BXGT007435 Replicase polyprotein 1a reviewed 1a - 8800 - -
reviewed BXGT007435 Replicase polyprotein 1a reviewed 1a - 11500 - -
reviewed BXGT007435 Replicase polyprotein 1a reviewed 1a - 700 - -
reviewed BXGT008751 Acetylcholinesterase reviewed Enzyme ACHE >100000 - - -
reviewed BXGT003942 Cocaine esterase reviewed Enzyme CES2 1410 - - -
reviewed BXGT003942 Cocaine esterase reviewed Enzyme CES2 14550 - - -
reviewed BXGT008830 Liver carboxylesterase 1 reviewed Enzyme CES1 26250 - - -
reviewed BXGT009335 Tyrosine-protein phosphatase non-receptor type 6 reviewed PTPN6 - 1970 - -
reviewed BXGT012856 Tyrosine-protein phosphatase non-receptor type 11 reviewed PTPN11 - 2570 - -
CHEMBL CHEMBL363535
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
Q194T2 BXGT013743 Non-structural protein 1 unreviewed - NS1 Potency '=' 1412 nM
Q13148 BXGT013318 TAR DNA-binding protein 43 reviewed - TARDBP Potency - 6309 nM
P54132 BXGT011032 Bloom syndrome protein reviewed - BLM Potency '=' 25118 nM
P0C6U8 BXGT007435 Replicase polyprotein 1a reviewed - 1a Inhibition - - -
O14746 BXGT004091 Telomerase reverse transcriptase reviewed Enzyme TERT Inhibition '=' 65 %
O00748 BXGT003942 Cocaine esterase reviewed Enzyme CES2 Ki '=' 14550 nM
Q99685 BXGT019948 Monoglyceride lipase reviewed Enzyme MGLL Inhibition '=' 15 %
P38398 BXGT010037 Breast cancer type 1 susceptibility protein reviewed Enzyme BRCA1 Potency - 3162 nM
Q96QE3 BXGT019718 ATPase family AAA domain-containing protein 5 reviewed - ATAD5 Potency - 29081 nM
Q9UNA4 BXGT021785 DNA polymerase iota reviewed - POLI Potency - 6309 nM
Q96KQ7 BXGT019687 Histone-lysine N-methyltransferase EHMT2 reviewed Epigenetic regulator EHMT2 Potency - 3162 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 2909 nM
P10636 BXGT007596 Microtubule-associated protein tau reviewed - MAPT Potency '=' 14125 nM
Q99814 BXGT019965 Endothelial PAS domain-containing protein 1 reviewed Transcription factor EPAS1 IC50 '=' 12500 nM
Q16665 BXGT013653 Hypoxia-inducible factor 1-alpha reviewed Transcription factor HIF1A IC50 '=' 12500 nM
Q99814 BXGT019965 Endothelial PAS domain-containing protein 1 reviewed Transcription factor EPAS1 IC50 '=' 8510 nM
Q16665 BXGT013653 Hypoxia-inducible factor 1-alpha reviewed Transcription factor HIF1A IC50 '=' 8510 nM
O75496 BXGT005132 Geminin reviewed - GMNN Potency - 5173 nM
P04637 BXGT006243 Cellular tumor antigen p53 reviewed Transcription factor TP53 Potency - 2511 nM
Q99700 BXGT019949 Ataxin-2 reviewed Nucleic acid binding ATXN2 Potency - 10000 nM
P51450 BXGT010847 Nuclear receptor ROR-gamma reviewed - Rorc Potency '=' 10000 nM
P10520 BXGT007576 Streptokinase A reviewed - ska EC50 '>' 150000 nM
P10636 BXGT007596 Microtubule-associated protein tau reviewed - MAPT Potency '=' 1995 nM
P83916 BXGT012025 Chromobox protein homolog 1 reviewed Epigenetic regulator CBX1 Potency - 15848 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 4610 nM
P23141 BXGT008830 Liver carboxylesterase 1 reviewed Enzyme CES1 Ki '=' 26250 nM
O89049 BXGT005293 Thioredoxin reductase 1, cytoplasmic reviewed - Txnrd1 Potency - 39810 nM
P00784 BXGT005655 Papain reviewed - Inhibition - - -
P10520 BXGT007576 Streptokinase A reviewed - ska EC50 '=' 2753 nM
Q9Y253 BXGT022216 DNA polymerase eta reviewed - POLH Potency - 28183 nM
O75496 BXGT005132 Geminin reviewed - GMNN Potency - 12995 nM
Q15022 BXGT013523 Polycomb protein SUZ12 reviewed Nucleic acid binding SUZ12 IC50 '=' 8900 nM
O75530 BXGT005135 Polycomb protein EED reviewed - EED IC50 '=' 8900 nM
Q15910 BXGT013612 Histone-lysine N-methyltransferase EZH2 reviewed Epigenetic regulator EZH2 IC50 '=' 8900 nM
P53350 BXGT010984 Serine/threonine-protein kinase PLK1 reviewed Kinase PLK1 Potency - 26679 nM
Q99685 BXGT019948 Monoglyceride lipase reviewed Enzyme MGLL Inhibition '=' 31 %
P22303 BXGT008751 Acetylcholinesterase reviewed Enzyme ACHE IC50 '>' 50000 nM
Q15022 BXGT013523 Polycomb protein SUZ12 reviewed Nucleic acid binding SUZ12 Inhibition - - -
O75530 BXGT005135 Polycomb protein EED reviewed - EED Inhibition - - -
Q15910 BXGT013612 Histone-lysine N-methyltransferase EZH2 reviewed Epigenetic regulator EZH2 Inhibition - - -
P08659 BXGT006805 Luciferin 4-monooxygenase reviewed - Potency - 10691 nM
P08183 BXGT006741 ATP-dependent translocase ABCB1 reviewed Transporter ABCB1 Inhibition '=' 50 %
Q9UIF8 BXGT021718 Bromodomain adjacent to zinc finger domain protein 2B reviewed - BAZ2B Potency - 35481 nM
Q962Y6 BXGT019597 Thioredoxin glutathione reductase unreviewed - TGR Potency '=' 8912 nM
O00748 BXGT003942 Cocaine esterase reviewed Enzyme CES2 Inhibition '=' 68 %
P22303 BXGT008751 Acetylcholinesterase reviewed Enzyme ACHE Ki '>' 100000 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency '=' 11220 nM
Q9YQ12 BXGT022394 Protease unreviewed - protease IC50 '=' 45900 nM
P01215 BXGT005743 Glycoprotein hormones alpha chain reviewed - CGA Potency - 5011 nM
Q9UBT6 BXGT021664 DNA polymerase kappa reviewed - POLK Potency - 79432 nM
P0C6U8 BXGT007435 Replicase polyprotein 1a reviewed - 1a IC50 '=' 8800 nM
P0C6U8 BXGT007435 Replicase polyprotein 1a reviewed - 1a IC50 '=' 700 nM
P0C6U8 BXGT007435 Replicase polyprotein 1a reviewed - 1a IC50 '=' 11500 nM
Q99685 BXGT019948 Monoglyceride lipase reviewed Enzyme MGLL Inhibition '=' 58 %
O75164 BXGT005104 Lysine-specific demethylase 4A reviewed - KDM4A Potency - 35481 nM
O00748 BXGT003942 Cocaine esterase reviewed Enzyme CES2 Ki '=' 1410 nM
P39748 BXGT010134 Flap endonuclease 1 reviewed Enzyme FEN1 Potency - 10000 nM
P06746 BXGT006496 DNA polymerase beta reviewed Enzyme POLB Potency '=' 19952 nM
P07943 BXGT006700 Aldo-keto reductase family 1 member B1 reviewed - Akr1b1 IC50 '=' 10000 nM
P11473 BXGT007709 Vitamin D3 receptor reviewed Nuclear receptor VDR Potency - 63095 nM
P0C6U8 BXGT007435 Replicase polyprotein 1a reviewed - 1a IC50 '=' 38700 nM
P0C6U8 BXGT007435 Replicase polyprotein 1a reviewed - 1a Ki '=' 13700 nM
Q99685 BXGT019948 Monoglyceride lipase reviewed Enzyme MGLL Inhibition '=' 12 %
P63092 BXGT011495 Guanine nucleotide-binding protein G(s) subunit alpha isoforms short reviewed - GNAS Potency - 5623 nM
O97447 BXGT005436 Putative fructose-1,6-bisphosphate aldolase unreviewed - ald Potency '=' 1255 nM
Q13526 BXGT013369 Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 reviewed - PIN1 Potency - 89125 nM
P29350 BXGT009335 Tyrosine-protein phosphatase non-receptor type 6 reviewed - PTPN6 IC50 '=' 1970 nM
Q06124 BXGT012856 Tyrosine-protein phosphatase non-receptor type 11 reviewed - PTPN11 IC50 '=' 2570 nM
O94782 BXGT005332 Ubiquitin carboxyl-terminal hydrolase 1 reviewed Enzyme USP1 Potency - 28183 nM
O95398 BXGT005378 Rap guanine nucleotide exchange factor 3 reviewed Enzyme modulator RAPGEF3 Potency - 79432 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00880 Stauntonia obovatifoliola Stauntonia obovatifoliola Others
BXGF01040 Euphorbia sancta Euphorbia sancta Others
BXGF01073 Veronicastrum sibiricum Veronicastrum sibiricum Medicinal Plant
BXGF01156 Senecio madagascariensis Senecio madagascariensis Human Edible Plant
BXGF01243 Asphodeline tenuior Asphodeline tenuior Others
BXGF01277 Glycyrrhiza triphylla Glycyrrhiza triphylla Others
BXGF01390 Delphinium cyphoplectrum Delphinium cyphoplectrum Others
BXGF01481 Glycine falcata Glycine falcata Others
BXGF01553 Iris hoogiana Iris hoogiana Others
BXGF01801 Bothriocline longipes Bothriocline longipes Medicinal Plant
BXGF01856 Aquilaria sinensis Aquilaria sinensis Medicinal Plant
BXGF01940 Salvia trijuga Salvia trijuga Medicinal Plant
BXGF02030 Angelica decursiva Angelica decursiva Medicinal Plant
BXGF02332 Salvia castanea Salvia castanea Medicinal Plant
BXGF02481 Prunella vulgaris Prunella vulgaris Medicinal Plant
BXGF02688 Salvia yunnanensis Salvia yunnanensis Medicinal Plant
BXGF02830 Amaranthus hybr Amaranthus hybr Medicinal Plant
BXGF02889 Salvia prionitis Salvia prionitis Medicinal Plant
BXGF03199 Combretum indicum Combretum indicum Medicinal Plant
BXGF03376 Notholaena dealbata Notholaena dealbata Others
BXGF03539 Picradeniopsis pringlei Picradeniopsis pringlei Others
BXGF03744 Artemisia siversiana Artemisia siversiana Others
BXGF03882 Uvaria klaineana Uvaria klaineana Medicinal Plant
BXGF03927 Viburnum sieboldi Viburnum sieboldi Medicinal Plant
BXGF04075 Amentotaxus yunnanensis Amentotaxus yunnanensis Medicinal Plant
BXGF04096 Vicia sativa Vicia sativa Medicinal Plant
BXGF04106 Salvia przewalskii Salvia przewalskii Medicinal Plant
BXGF04145 Salvia digitaloides Salvia digitaloides Medicinal Plant
BXGF04156 Euphorbia retusa Euphorbia retusa Others
BXGF04422 Camptothecium lutescens Camptothecium lutescens Others
BXGF04578 Metzgeria pubescens Metzgeria pubescens Others
BXGF04603 Dioscorea communis Dioscorea communis Medicinal Plant
BXGF04934 Salvia przewalskll Salvia przewalskll Others
BXGF05228 Deguelia hatschbachii Deguelia hatschbachii Others
BXGF05260 Peucedanum praeruptorum Peucedanum praeruptorum Medicinal Plant
BXGF05526 Salvia miltiorrhiza Salvia miltiorrhiza Medicinal Plant
BXGF05621 Agathosma thymifolia Agathosma thymifolia 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