BDBM375171 6-{[1-(6-chloro-2-oxo-1,2-::US10253015, Compound I-31

SMILES: Cc1nc(NC2(CC2)c2cc3cc(Cl)ccc3[nH]c2=O)ccc1C#N

InChI Key: InChIKey=BLXUDHRDQAGDOD-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 = 375171   

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
Isocitrate dehydrogenase [NADP] cytoplasmic (Homo sapiens (Human))	BDBM375171 (6-{[1-(6-chloro-2-oxo-1,2- | US10253015, Compound ...) Show SMILES Cc1nc(NC2(CC2)c2cc3cc(Cl)ccc3[nH]c2=O)ccc1C#N Show InChI InChI=1S/C19H15ClN4O/c1-11-12(10-21)2-5-17(22-11)24-19(6-7-19)15-9-13-8-14(20)3-4-16(13)23-18(15)25/h2-5,8-9H,6-7H2,1H3,(H,22,24)(H,23,25)	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
Forma Therapeutics, Inc. Curated by ChEMBL					Assay Description Inhibition of human Myc-DDK-tagged IDH1 R132H mutant assessed as reduction in NADPH consumption pre-incubated for 15 mins followed by alpha-ketogluta...				J Med Chem 62: 6575-6596 (2019) Article DOI: 10.1021/acs.jmedchem.9b00362
					More data for this Ligand-Target Pair
IDH1 R132H (Homo sapiens (Human))	BDBM375171 (6-{[1-(6-chloro-2-oxo-1,2- | US10253015, Compound ...) Show SMILES Cc1nc(NC2(CC2)c2cc3cc(Cl)ccc3[nH]c2=O)ccc1C#N Show InChI InChI=1S/C19H15ClN4O/c1-11-12(10-21)2-5-17(22-11)24-19(6-7-19)15-9-13-8-14(20)3-4-16(13)23-18(15)25/h2-5,8-9H,6-7H2,1H3,(H,22,24)(H,23,25)	PDB GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	55	n/a	n/a	n/a	n/a	n/a	n/a
Vanderbilt University School of Medicine					Assay Description Assays were performed in a 384-well black plate. An aliquot of 250 nL of compound was incubated with 10 μL of 30 nM IDH1-R132H or 10 nM IDH1-R13...				Proc Natl Acad Sci U S A 97: 925-30 (2000) BindingDB Entry DOI: 10.7270/Q23F4S02
					More data for this Ligand-Target Pair