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BDBM50241028 1-Isopropyl-1H-benzotriazole-5-carboxylic acid::1-isopropyl-benzotraizole-5-carboxylic acid::CHEMBL381638

SMILES: CC(C)n1nnc2cc(ccc12)C(O)=O

InChI Key: InChIKey=RUTVRAJKELSHCC-UHFFFAOYSA-N

Data: 2 EC50

Find this compound or compounds like it in BindingDB or PDB:
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50241028   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
HM74 nicotinic acid GPCR


(Homo sapiens (Human))
BDBM50241028
PNG
(1-Isopropyl-1H-benzotriazole-5-carboxylic acid | 1...)
Show SMILES CC(C)n1nnc2cc(ccc12)C(O)=O
Show InChI InChI=1S/C10H11N3O2/c1-6(2)13-9-4-3-7(10(14)15)5-8(9)11-12-13/h3-6H,1-2H3,(H,14,15)
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PubMed
n/an/an/an/a 398n/an/an/an/a



TBA

Curated by PDSP Ki Database


Assay Description
Agonistic activity at GPR109b by cAMP whole cell assay


J Med Chem 49: 1227-30 (2006)


Article DOI: 10.1021/jm051099t
BindingDB Entry DOI: 10.7270/Q2SF2ZZ4
More data for this
Ligand-Target Pair
Hydroxycarboxylic acid receptor 2


(Homo sapiens (Human))
BDBM50241028
PNG
(1-Isopropyl-1H-benzotriazole-5-carboxylic acid | 1...)
Show SMILES CC(C)n1nnc2cc(ccc12)C(O)=O
Show InChI InChI=1S/C10H11N3O2/c1-6(2)13-9-4-3-7(10(14)15)5-8(9)11-12-13/h3-6H,1-2H3,(H,14,15)
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/an/an/a 400n/an/an/an/a



Arena Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
Activity at GPR109a (unknown origin) assessed as inhibition of forskolin-stimulated cAMP production


J Med Chem 51: 7653-62 (2008)


Article DOI: 10.1021/jm800896z
BindingDB Entry DOI: 10.7270/Q27D2TZ5
More data for this
Ligand-Target Pair