null

SMILES: COCCOC[C@@]1(O)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2

InChI Key: InChIKey=ZUXNHYOUVHTGMH-MDAWNFFJSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 471430   

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
Bcl-2-like protein 11 [51-76]/Induced myeloid leukemia cell differentiation protein Mcl-1 [171-327] (Homo sapiens (Human))	BDBM471430 (US10821115, Example 100445 | US11224601, Example 1...) Show SMILES COCCOC[C@@]1(O)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2 |r,t:8| Show InChI InChI=1S/C36H47ClN2O7S/c1-24-6-4-15-36(41,23-45-17-16-44-3)31-11-8-28(31)20-39-21-35(14-5-7-26-18-29(37)10-12-30(26)35)22-46-33-13-9-27(19-32(33)39)34(40)38-47(42,43)25(24)2/h4,9-10,12-13,15,18-19,24-25,28,31,41H,5-8,11,14,16-17,20-23H2,1-3H3,(H,38,40)/b15-4+/t24-,25+,28-,31+,35-,36-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	0.0400	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 [171-327] (Homo sapiens (Human))	BDBM471430 (US10821115, Example 100445 | US11224601, Example 1...) Show SMILES COCCOC[C@@]1(O)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)c2ccc3OC[C@]4(CCCc5cc(Cl)ccc45)CN(C[C@@H]4CC[C@@H]14)c3c2 |r,t:8| Show InChI InChI=1S/C36H47ClN2O7S/c1-24-6-4-15-36(41,23-45-17-16-44-3)31-11-8-28(31)20-39-21-35(14-5-7-26-18-29(37)10-12-30(26)35)22-46-33-13-9-27(19-32(33)39)34(40)38-47(42,43)25(24)2/h4,9-10,12-13,15,18-19,24-25,28,31,41H,5-8,11,14,16-17,20-23H2,1-3H3,(H,38,40)/b15-4+/t24-,25+,28-,31+,35-,36-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.0400	n/a	n/a	n/a	n/a	n/a	n/a
AMGEN INC. US Patent					Assay Description The inhibition of the Mcl-1/Bim interaction was measured using a time-resolved fluorescence resonance energy transfer (TR-FRET) assay. The recombinan...				US Patent US10821115 (2020)
					More data for this Ligand-Target Pair