BDBM50195207 2-oxo-3-(5-(piperidin-1-ylmethyl)-1H-indol-2-yl)-1,2-dihydroquinoline-6-carbonitrile::CHEMBL415656

SMILES: O=c1[nH]c2ccc(cc2cc1-c1cc2cc(CN3CCCCC3)ccc2[nH]1)C#N

InChI Key: InChIKey=MWAPYBBXQBEQIA-UHFFFAOYSA-N

Data: 1 IC50  1 EC50

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 = 50195207   

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
Serine/threonine-protein kinase Chk1 (Homo sapiens (Human))	BDBM50195207 (2-oxo-3-(5-(piperidin-1-ylmethyl)-1H-indol-2-yl)-1...) Show SMILES O=c1[nH]c2ccc(cc2cc1-c1cc2cc(CN3CCCCC3)ccc2[nH]1)C#N Show InChI InChI=1S/C24H22N4O/c25-14-16-4-6-22-18(10-16)12-20(24(29)27-22)23-13-19-11-17(5-7-21(19)26-23)15-28-8-2-1-3-9-28/h4-7,10-13,26H,1-3,8-9,15H2,(H,27,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.60	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of human CHEK1				Bioorg Med Chem Lett 16: 5907-12 (2006) Article DOI: 10.1016/j.bmcl.2006.08.053 BindingDB Entry DOI: 10.7270/Q27H1J73
					More data for this Ligand-Target Pair				3D Structure (docked)
Serine/threonine-protein kinase Chk1 (Homo sapiens (Human))	BDBM50195207 (2-oxo-3-(5-(piperidin-1-ylmethyl)-1H-indol-2-yl)-1...) Show SMILES O=c1[nH]c2ccc(cc2cc1-c1cc2cc(CN3CCCCC3)ccc2[nH]1)C#N Show InChI InChI=1S/C24H22N4O/c25-14-16-4-6-22-18(10-16)12-20(24(29)27-22)23-13-19-11-17(5-7-21(19)26-23)15-28-8-2-1-3-9-28/h4-7,10-13,26H,1-3,8-9,15H2,(H,27,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	170	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Release of camptothecin-induced cell cycle arrest in NCI-H1299 cells mediated by CHEK1 inhibition				Bioorg Med Chem Lett 16: 5907-12 (2006) Article DOI: 10.1016/j.bmcl.2006.08.053 BindingDB Entry DOI: 10.7270/Q27H1J73
					More data for this Ligand-Target Pair				3D Structure (docked)