BDBM50111981 CHEMBL3605400

SMILES: CN1C(=S)N\C(=C\c2ccc(o2)-c2ccc(F)c(F)c2)C1=O

InChI Key: InChIKey=FFXLBHNCWIKYFU-KPKJPENVSA-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 = 50111981   

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))	BDBM50111981 (CHEMBL3605400) Show SMILES CN1C(=S)N\C(=C\c2ccc(o2)-c2ccc(F)c(F)c2)C1=O Show InChI InChI=1S/C15H10F2N2O2S/c1-19-14(20)12(18-15(19)22)7-9-3-5-13(21-9)8-2-4-10(16)11(17)6-8/h2-7H,1H3,(H,18,22)/b12-7+	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Baylor College of Medicine Curated by ChEMBL					Assay Description Inhibition of recombinant human IDH1 R132H mutant expressed in Escherichia coli using alpha-KG as substrate preincubated for 5 mins followed by subst...				J Med Chem 58: 6899-908 (2015) BindingDB Entry DOI: 10.7270/Q2M61N2D
					More data for this Ligand-Target Pair