Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Kinesin-like protein KIF18A' and Ligand = 'BDBM50404031'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Kinesin-like protein KIF18A (Homo sapiens)	BDBM50404031 (CHEMBL5270982) Show SMILES CN(C)c1cccc2c(cccc12)S(=O)(=O)NCCNC(NCCCOc1cccc(CN2CCCCC2)c1)=NC#N |w:39.43| Show InChI InChI=1S/C31H41N7O3S/c1-37(2)29-14-7-13-28-27(29)12-8-15-30(28)42(39,40)36-18-17-34-31(35-24-32)33-16-9-21-41-26-11-6-10-25(22-26)23-38-19-4-3-5-20-38/h6-8,10-15,22,36H,3-5,9,16-21,23H2,1-2H3,(H2,33,34,35)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem		n/a	n/a	166	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity against Tachykinin receptor 2 was measured by Hamster isolated trachea(HT) assay.				Citation and Details
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