BDBM50313401 (4aS,5R,10bS)-7-fluoro-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinoline::CHEMBL1078572

SMILES: Fc1cc(cc2[C@H]3OCCC[C@H]3[C@@H](Nc12)c1ccccc1)C(F)(F)F

InChI Key: InChIKey=TVVSAVABKGRZOD-OWQGQXMQSA-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 = 50313401   

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 KIF11 (Homo sapiens (Human))	BDBM50313401 ((4aS,5R,10bS)-7-fluoro-5-phenyl-9-(trifluoromethyl...) Show SMILES Fc1cc(cc2[C@H]3OCCC[C@H]3[C@@H](Nc12)c1ccccc1)C(F)(F)F |r| Show InChI InChI=1S/C19H17F4NO/c20-15-10-12(19(21,22)23)9-14-17(15)24-16(11-5-2-1-3-6-11)13-7-4-8-25-18(13)14/h1-3,5-6,9-10,13,16,18,24H,4,7-8H2/t13-,16-,18-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	90	n/a	n/a	n/a	n/a	n/a	n/a
Merck Serono Curated by ChEMBL					Assay Description Inhibition of ATPase activity of human recombinant EG5 assessed as ATP hydrolysis by pyruvate kinase-lactate dehydrogenase coupled assay				Bioorg Med Chem Lett 20: 1491-5 (2010) Article DOI: 10.1016/j.bmcl.2010.01.110 BindingDB Entry DOI: 10.7270/Q2KD1ZWN
					More data for this Ligand-Target Pair