Showing entry for 4-(1,3-Benzothiazol-2-Yl)-2-Methylaniline


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0020756
Compound Name4-(1,3-Benzothiazol-2-Yl)-2-Methylaniline
Structure
FormulaC14H12N2S
InchiKeyIDBCUMFOZBUJCL-UHFFFAOYSA-N
SMILESNc1ccc(cc1C)c1nc2c(s1)cccc2
InchiInChI=1S/C14H12N2S/c1-9-8-10(6-7-11(9)15)14-16-12-4-2-3-5-13(12)17-14/h2-8H,15H2,1H3
IUPAC4-(1,3-benzothiazol-2-yl)-2-methylaniline
Molecular Weight240.07
Pubchem Id384525
Chembl IdCHEMBL11825
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 50141278
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 BXGT003525 Nuclear hormone receptor family member daf-12 reviewed daf-12 - - - 67649
reviewed BXGT003525 Nuclear hormone receptor family member daf-12 reviewed daf-12 - 67649 - -
reviewed BXGT011101 Oxysterols receptor LXR-beta reviewed Nuclear receptor NR1H2 - - - 67649
reviewed BXGT011101 Oxysterols receptor LXR-beta reviewed Nuclear receptor NR1H2 - 67649 - -
reviewed BXGT004129 1-acyl-sn-glycerol-3-phosphate acyltransferase beta reviewed AGPAT2 - >40000 - -
CHEMBL CHEMBL11825
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
P80244 BXGT011887 ATP-dependent Clp protease proteolytic subunit reviewed - clpP Potency - 1258 nM
O75496 BXGT005132 Geminin reviewed - GMNN Potency - 18356 nM
P83916 BXGT012025 Chromobox protein homolog 1 reviewed Epigenetic regulator CBX1 Potency - 79432 nM
P84022 BXGT012027 Mothers against decapentaplegic homolog 3 reviewed Transcription factor SMAD3 Potency - 112 nM
O95149 BXGT005350 Snurportin-1 reviewed - SNUPN Potency - 44668 nM
Q14974 BXGT013516 Importin subunit beta-1 reviewed Transporter KPNB1 Potency - 44668 nM
P49798 BXGT010745 Regulator of G-protein signaling 4 reviewed Enzyme modulator RGS4 Potency - 100000 nM
P55055 BXGT011101 Oxysterols receptor LXR-beta reviewed Nuclear receptor NR1H2 IC50 '>' 67649 nM
P55055 BXGT011101 Oxysterols receptor LXR-beta reviewed Nuclear receptor NR1H2 EC50 '>' 67649 nM
O15120 BXGT004129 1-acyl-sn-glycerol-3-phosphate acyltransferase beta reviewed - AGPAT2 IC50 '>' 40000 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 29092 nM
Q16236 BXGT013624 Nuclear factor erythroid 2-related factor 2 reviewed Enzyme NFE2L2 Potency - 2059 nM
O89049 BXGT005293 Thioredoxin reductase 1, cytoplasmic reviewed - Txnrd1 Potency - 3162 nM
O75164 BXGT005104 Lysine-specific demethylase 4A reviewed - KDM4A Potency - 89125 nM
O75496 BXGT005132 Geminin reviewed - GMNN Potency - 20596 nM
P43220 BXGT010367 Glucagon-like peptide 1 receptor reviewed G-protein coupled receptor GLP1R Potency - 7943 nM
O95149 BXGT005350 Snurportin-1 reviewed - SNUPN Potency - 22387 nM
Q14974 BXGT013516 Importin subunit beta-1 reviewed Transporter KPNB1 Potency - 22387 nM
P62826 BXGT011463 GTP-binding nuclear protein Ran reviewed Enzyme modulator RAN Potency - 22387 nM
Q13148 BXGT013318 TAR DNA-binding protein 43 reviewed - TARDBP Potency - 17782 nM
P17405 BXGT008304 Sphingomyelin phosphodiesterase reviewed Enzyme SMPD1 Potency - 25118 nM
Q9NUW8 BXGT021219 Tyrosyl-DNA phosphodiesterase 1 reviewed Enzyme TDP1 Potency - 14581 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00042 Safflower Carthamus tinctorius Herbs and Spices
BXGF03199 Combretum indicum Combretum indicum Medicinal Plant
BXGF03910 Polyalthia nemoralis Polyalthia nemoralis Medicinal Plant
BXGF05681 Clematis chinensis Clematis chinensis Medicinal Plant
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