BDBM50353818 CHEMBL1829257

SMILES: CCC(N(CCCN)C(=O)c1ccc(C)cc1)c1nc2ccsc2c(=O)n1Cc1cscn1

InChI Key: InChIKey=NFSUCTUBXVJXNX-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 = 50353818   

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))	BDBM50353818 (CHEMBL1829257) Show SMILES CCC(N(CCCN)C(=O)c1ccc(C)cc1)c1nc2ccsc2c(=O)n1Cc1cscn1 Show InChI InChI=1S/C24H27N5O2S2/c1-3-20(28(11-4-10-25)23(30)17-7-5-16(2)6-8-17)22-27-19-9-12-33-21(19)24(31)29(22)13-18-14-32-15-26-18/h5-9,12,14-15,20H,3-4,10-11,13,25H2,1-2H3	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	9.09E+3	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of human recombinant C-terminal His6-tagged KSP ATPase activity after 1 hr by malachite green assay				J Med Chem 54: 6734-50 (2011) Article DOI: 10.1021/jm200629m BindingDB Entry DOI: 10.7270/Q2ZC838Z
					More data for this Ligand-Target Pair