null

SMILES: C[C@H]1C\C=C\[C@H](O)[C@@H]2CC[C@H]2CN2C[C@@]3(CCCc4cc(Cl)ccc34)COc3ccc(cc23)C(=O)N=[S@](=O)(NC(=O)c2cc3CO[C@@H](CN4CCN5CCOC[C@H]5C4)Cn3c2)[C@@H]1C

InChI Key: InChIKey=CJBOFCYUNJTLPW-CNVIZEBDSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 493759   

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
Induced myeloid leukemia cell differentiation protein Mcl-1 [171-327] (Homo sapiens (Human))	BDBM493759 (US10988451, Example 229) Show SMILES C[C@H]1C\C=C\[C@H](O)[C@@H]2CC[C@H]2CN2C[C@@]3(CCCc4cc(Cl)ccc34)COc3ccc(cc23)C(=O)N=[S@](=O)(NC(=O)c2cc3CO[C@@H](CN4CCN5CCOC[C@H]5C4)Cn3c2)[C@@H]1C |r,t:3| Show InChI InChI=1S/C48H61ClN6O7S/c1-31-5-3-7-44(56)41-11-8-35(41)22-55-29-48(14-4-6-33-19-37(49)10-12-42(33)48)30-62-45-13-9-34(21-43(45)55)46(57)50-63(59,32(31)2)51-47(58)36-20-38-28-61-40(26-54(38)23-36)25-52-15-16-53-17-18-60-27-39(53)24-52/h3,7,9-10,12-13,19-21,23,31-32,35,39-41,44,56H,4-6,8,11,14-18,22,24-30H2,1-2H3,(H,50,51,57,58,59)/b7-3+/t31-,32+,35-,39+,40-,41+,44-,48-,63-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.0300	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 (17...				US Patent US10988451 (2021)
					More data for this Ligand-Target Pair