Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Bcl-2-like protein 11 [51-76]/Induced myeloid leukemia cell differentiation protein Mcl-1 [171-327]' and Ligand = 'BDBM449674'   

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
Bcl-2-like protein 11 [51-76]/Induced myeloid leukemia cell differentiation protein Mcl-1 [171-327] (Homo sapiens (Human))	BDBM449674 (US10703733, Example 287 | US10988451, Example 287 ...) Show SMILES COC1CCN(CC1)C1CN(C1)C(=O)N[S@@]1(=O)=NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@H]4[C@@H](OC)\C=C\C[C@H](C)C1)c3c2 |r,t:52| Show InChI InChI=1S/C42H56ClN5O6S/c1-28-6-4-8-38(53-3)35-12-9-31(35)22-48-26-42(17-5-7-29-20-32(43)11-13-36(29)42)27-54-39-14-10-30(21-37(39)48)40(49)44-55(51,25-28)45-41(50)47-23-33(24-47)46-18-15-34(52-2)16-19-46/h4,8,10-11,13-14,20-21,28,31,33-35,38H,5-7,9,12,15-19,22-27H2,1-3H3,(H,44,45,49,50,51)/b8-4+/t28-,31-,35+,38-,42-,55-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	0.0290	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q24B357N
					More data for this Ligand-Target Pair
Bcl-2-like protein 11 [51-76]/Induced myeloid leukemia cell differentiation protein Mcl-1 [171-327] (Homo sapiens (Human))	BDBM449674 (US10703733, Example 287 | US10988451, Example 287 ...) Show SMILES COC1CCN(CC1)C1CN(C1)C(=O)N[S@@]1(=O)=NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@H]4[C@@H](OC)\C=C\C[C@H](C)C1)c3c2 |r,t:52| Show InChI InChI=1S/C42H56ClN5O6S/c1-28-6-4-8-38(53-3)35-12-9-31(35)22-48-26-42(17-5-7-29-20-32(43)11-13-36(29)42)27-54-39-14-10-30(21-37(39)48)40(49)44-55(51,25-28)45-41(50)47-23-33(24-47)46-18-15-34(52-2)16-19-46/h4,8,10-11,13-14,20-21,28,31,33-35,38H,5-7,9,12,15-19,22-27H2,1-3H3,(H,44,45,49,50,51)/b8-4+/t28-,31-,35+,38-,42-,55-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.0290	n/a	n/a	n/a	n/a	n/a	n/a
Gilead Sciences, Inc. US Patent					Assay Description The AlphaLISA assay was performed in a 384-well Proxiplate in a total volume of 40 μL. The reaction mixture contained 0.0625 nM 6×His-Mcl-1 (171...				US Patent US10703733 (2020) BindingDB Entry DOI: 10.7270/Q2XK8JK4
					More data for this Ligand-Target Pair