BDBM12399 2-Carboxyindole Scaffold 44::3-Cyano-1-(3-methoxy-benzyl)-7-methyl-1H-indole-2-carboxylic acid (1-isopropylpiperidin-4-yl)-amide::3-cyano-1-[(3-methoxyphenyl)methyl]-7-methyl-N-[1-(propan-2-yl)piperidin-4-yl]-1H-indole-2-carboxamide

SMILES: COc1cccc(Cn2c(C(=O)NC3CCN(CC3)C(C)C)c(C#N)c3cccc(C)c23)c1

InChI Key: InChIKey=ZQRWCINGUCSZGO-UHFFFAOYSA-N

Data: 1 KI

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 1 hit for monomerid = 12399   

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
Coagulation factor X (Homo sapiens (Human))	BDBM12399 (2-Carboxyindole Scaffold 44 | 3-Cyano-1-(3-methoxy...) Show SMILES COc1cccc(Cn2c(C(=O)NC3CCN(CC3)C(C)C)c(C#N)c3cccc(C)c23)c1 Show InChI InChI=1S/C27H32N4O2/c1-18(2)30-13-11-21(12-14-30)29-27(32)26-24(16-28)23-10-5-7-19(3)25(23)31(26)17-20-8-6-9-22(15-20)33-4/h5-10,15,18,21H,11-14,17H2,1-4H3,(H,29,32)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	406	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Aventis Pharma					Assay Description The inhibitory effect of test compound for human fXa was determined by using the chromogenic substrates S-2765. The hydrolysis rates of chromogenic s...				J Med Chem 48: 4511-25 (2005) Article DOI: 10.1021/jm0490540 BindingDB Entry DOI: 10.7270/Q21834RB
					More data for this Ligand-Target Pair