Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Induced myeloid leukemia cell differentiation protein Mcl-1' and Ligand = 'BDBM50519027'   

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
Induced myeloid leukemia cell differentiation protein Mcl-1 (Homo sapiens (Human))	BDBM50519027 (CHEMBL4547333) Show SMILES CCc1sc2ncnc(N[C@H](C)C(O)=O)c2c1-c1ccccc1OCc1ccccc1 |r,wU:10.10,(33.92,-28.48,;33.15,-27.15,;31.61,-27.15,;30.71,-28.4,;29.24,-27.92,;27.91,-28.7,;26.57,-27.93,;26.57,-26.39,;27.9,-25.62,;27.9,-24.08,;26.56,-23.31,;26.55,-21.77,;25.23,-24.08,;23.89,-23.32,;25.23,-25.62,;29.24,-26.38,;30.71,-25.9,;31.18,-24.44,;30.15,-23.3,;30.62,-21.84,;32.13,-21.51,;33.16,-22.65,;32.69,-24.12,;33.72,-25.27,;35.23,-24.95,;36.26,-26.09,;35.78,-27.55,;36.81,-28.7,;38.32,-28.38,;38.79,-26.9,;37.76,-25.76,)| Show InChI InChI=1S/C24H23N3O3S/c1-3-19-20(21-22(27-15(2)24(28)29)25-14-26-23(21)31-19)17-11-7-8-12-18(17)30-13-16-9-5-4-6-10-16/h4-12,14-15H,3,13H2,1-2H3,(H,28,29)(H,25,26,27)/t15-/m1/s1	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.40E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Servier Research Institute of Medicinal Chemistry Curated by ChEMBL					Assay Description Displacement of N-terminal fluorescein labelled Puma-BH3 peptide from TEV-fused His-tagged human Mcl-1 expressed in Escherichia coliBL21(DE3) pLysS c...				J Med Chem 62: 6913-6924 (2019) Article DOI: 10.1021/acs.jmedchem.9b00134 BindingDB Entry DOI: 10.7270/Q2DZ0CPH
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