BDBM50037889 CHEMBL3358265

SMILES: COCc1cc(ccc1OC)C(=O)NC(Cc1ccc(cc1)-c1cccc(OC(F)(F)F)c1)C(=O)NCCN(C)C

InChI Key: InChIKey=ZEHRNFWJWQMEEQ-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50037889   

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
Kinesin-like protein KIFC1 (Homo sapiens (Human))	BDBM50037889 (CHEMBL3358265) Show SMILES COCc1cc(ccc1OC)C(=O)NC(Cc1ccc(cc1)-c1cccc(OC(F)(F)F)c1)C(=O)NCCN(C)C Show InChI InChI=1S/C30H34F3N3O5/c1-36(2)15-14-34-29(38)26(35-28(37)23-12-13-27(40-4)24(17-23)19-39-3)16-20-8-10-21(11-9-20)22-6-5-7-25(18-22)41-30(31,32)33/h5-13,17-18,26H,14-16,19H2,1-4H3,(H,34,38)(H,35,37)	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	960	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of recombinant N-terminal His6-tagged KIFC1 (Q305-K673 aa) (unknown origin) expressed in Escherichia coli BL21 (DE3) by malachite green as...				J Med Chem 57: 9958-70 (2014) Article DOI: 10.1021/jm501179r BindingDB Entry DOI: 10.7270/Q2QF8VG8
					More data for this Ligand-Target Pair