BDBM50023142 1H-Indole-2-carboxylic acid [6-(2-fluoro-phenyl)-1-methyl-4H-2,3,5,10b-tetraaza-benzo[e]azulen-4-yl]-amide(0.2EtOAc)::CHEMBL53907

SMILES: Cc1nnc2C(NC(=O)c3cc4ccccc4[nH]3)N=C(c3ccccc3F)c3ccccc3-n12

InChI Key: InChIKey=OLLDQMTZEMTSCS-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50023142   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Cholecystokinin receptor (Homo sapiens (Human))	BDBM50023142 (1H-Indole-2-carboxylic acid [6-(2-fluoro-phenyl)-1...) Show SMILES Cc1nnc2C(NC(=O)c3cc4ccccc4[nH]3)N=C(c3ccccc3F)c3ccccc3-n12 |t:20| Show InChI InChI=1S/C26H19FN6O/c1-15-31-32-25-24(30-26(34)21-14-16-8-2-6-12-20(16)28-21)29-23(17-9-3-5-11-19(17)27)18-10-4-7-13-22(18)33(15)25/h2-14,24,28H,1H3,(H,30,34)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Research Laboratories Curated by ChEMBL					Assay Description Displacement of [125I]-gastrin from guinea pig gastric glands				J Med Chem 31: 176-81 (1988) BindingDB Entry DOI: 10.7270/Q2ZS2VH2
					More data for this Ligand-Target Pair
Cholecystokinin receptor (RAT)	BDBM50023142 (1H-Indole-2-carboxylic acid [6-(2-fluoro-phenyl)-1...) Show SMILES Cc1nnc2C(NC(=O)c3cc4ccccc4[nH]3)N=C(c3ccccc3F)c3ccccc3-n12 |t:20| Show InChI InChI=1S/C26H19FN6O/c1-15-31-32-25-24(30-26(34)21-14-16-8-2-6-12-20(16)28-21)29-23(17-9-3-5-11-19(17)27)18-10-4-7-13-22(18)33(15)25/h2-14,24,28H,1H3,(H,30,34)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	0.200	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Research Laboratories Curated by ChEMBL					Assay Description Displacement of [125I]-CCK from Cholecystokinin receptor of rat pancreas				J Med Chem 31: 176-81 (1988) BindingDB Entry DOI: 10.7270/Q2ZS2VH2
					More data for this Ligand-Target Pair