null

SMILES: COCCOCOc1ccc2N([C@@H](CC(O)=O)[C@H](O)[C@@H](NC(=O)OCC=C)c2c1)C(=O)c1ccc2ccccc2c1

InChI Key: InChIKey=OTTKCKASRBDAJJ-MYKRZTLLSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50262590   

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 homolog (Mus musculus (Mouse))	BDBM50262590 (2-((2S,3R,4S)-1-(2-naphthoyl)-4-(allyloxycarbonyl)...) Show SMILES COCCOCOc1ccc2N([C@@H](CC(O)=O)[C@H](O)[C@@H](NC(=O)OCC=C)c2c1)C(=O)c1ccc2ccccc2c1 |r| Show InChI InChI=1S/C30H32N2O9/c1-3-12-40-30(37)31-27-23-16-22(41-18-39-14-13-38-2)10-11-24(23)32(25(28(27)35)17-26(33)34)29(36)21-9-8-19-6-4-5-7-20(19)15-21/h3-11,15-16,25,27-28,35H,1,12-14,17-18H2,2H3,(H,31,37)(H,33,34)/t25-,27-,28-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	5.00E+5	n/a	n/a	n/a	n/a	n/a
EntreMed Inc. Curated by ChEMBL					Assay Description Binding affinity to mouse Mcl-1 expressed in Escherichia coli BL21 cells				Bioorg Med Chem 16: 7443-9 (2008) Article DOI: 10.1016/j.bmc.2008.06.023 BindingDB Entry DOI: 10.7270/Q29023K1
					More data for this Ligand-Target Pair
Bcl2-associated agonist of cell death (Mus musculus (mouse))	BDBM50262590 (2-((2S,3R,4S)-1-(2-naphthoyl)-4-(allyloxycarbonyl)...) Show SMILES COCCOCOc1ccc2N([C@@H](CC(O)=O)[C@H](O)[C@@H](NC(=O)OCC=C)c2c1)C(=O)c1ccc2ccccc2c1 |r| Show InChI InChI=1S/C30H32N2O9/c1-3-12-40-30(37)31-27-23-16-22(41-18-39-14-13-38-2)10-11-24(23)32(25(28(27)35)17-26(33)34)29(36)21-9-8-19-6-4-5-7-20(19)15-21/h3-11,15-16,25,27-28,35H,1,12-14,17-18H2,2H3,(H,31,37)(H,33,34)/t25-,27-,28-/m0/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.00E+6	n/a	n/a	n/a	n/a	n/a
EntreMed Inc. Curated by ChEMBL					Assay Description Binding affinity to mouse Bcl-XL expressed in Escherichia coli BL21 cells				Bioorg Med Chem 16: 7443-9 (2008) Article DOI: 10.1016/j.bmc.2008.06.023 BindingDB Entry DOI: 10.7270/Q29023K1
					More data for this Ligand-Target Pair