BDBM50313443 CHEMBL1082249::N-(2-(((2R,4aS,5R,10bS)-9-bromo-7-fluoro-5-phenyl-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl)methylamino)ethyl)acetamide

SMILES: CC(=O)NCCNC[C@H]1CC[C@H]2[C@@H](Nc3c(F)cc(Br)cc3[C@H]2O1)c1ccccc1

InChI Key: InChIKey=PMAGPUQCJLWJIW-GPFNJZLUSA-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 = 50313443   

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 1 (Homo sapiens (Human))	BDBM50313443 (CHEMBL1082249 | N-(2-(((2R,4aS,5R,10bS)-9-bromo-7-...) Show SMILES CC(=O)NCCNC[C@H]1CC[C@H]2[C@@H](Nc3c(F)cc(Br)cc3[C@H]2O1)c1ccccc1 |r| Show InChI InChI=1S/C23H27BrFN3O2/c1-14(29)27-10-9-26-13-17-7-8-18-21(15-5-3-2-4-6-15)28-22-19(23(18)30-17)11-16(24)12-20(22)25/h2-6,11-12,17-18,21,23,26,28H,7-10,13H2,1H3,(H,27,29)/t17-,18+,21+,23+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6	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