BDBM50212500 4'-{7-[(2-pyrrolidin-1-yl-ethylamino)-methyl]-1,4-dihydro-indeno[1,2-c]pyrazol-3-yl}-biphenyl-4-ol::CHEMBL393603

SMILES: Oc1ccc(cc1)-c1ccc(cc1)-c1n[nH]c-2c1Cc1ccc(CNCCN3CCCC3)cc-21

InChI Key: InChIKey=PWYOAERBCUWSMR-UHFFFAOYSA-N

Data: 1 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50212500   

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))	BDBM50212500 (4'-{7-[(2-pyrrolidin-1-yl-ethylamino)-methyl]-1,4-...) Show SMILES Oc1ccc(cc1)-c1ccc(cc1)-c1n[nH]c-2c1Cc1ccc(CNCCN3CCCC3)cc-21 Show InChI InChI=1S/C29H30N4O/c34-25-11-9-22(10-12-25)21-5-7-23(8-6-21)28-27-18-24-4-3-20(17-26(24)29(27)32-31-28)19-30-13-16-33-14-1-2-15-33/h3-12,17,30,34H,1-2,13-16,18-19H2,(H,31,32)	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	7.10	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of recombinant CHK-mediated Cdc25C phosphorylation after 30 mins				Bioorg Med Chem Lett 17: 3618-23 (2007) Article DOI: 10.1016/j.bmcl.2007.04.055 BindingDB Entry DOI: 10.7270/Q2DR2V6Q
					More data for this Ligand-Target Pair