BDBM50194431 CHEMBL3954152

SMILES: COC(=O)[C@H](CO)NC(=O)[C@H](CCCCN(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)c1ccccc1

InChI Key: InChIKey=PJWSTQJTRDBBIU-LJEIBCANSA-N

Data: 5 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50194431   

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
E3 SUMO-protein ligase CBX4 (Homo sapiens (Human))	BDBM50194431 (CHEMBL3954152) Show SMILES COC(=O)[C@H](CO)NC(=O)[C@H](CCCCN(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)c1ccccc1 |r| Show InChI InChI=1S/C39H57N7O9/c1-25(2)21-30(38(53)43-29(19-13-14-20-46(4)5)36(51)45-32(24-47)39(54)55-6)44-34(49)26(3)41-37(52)31(22-27-15-9-7-10-16-27)42-33(48)23-40-35(50)28-17-11-8-12-18-28/h7-12,15-18,25-26,29-32,47H,13-14,19-24H2,1-6H3,(H,40,50)(H,41,52)(H,42,48)(H,43,53)(H,44,49)(H,45,51)/t26-,29-,30-,31-,32-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>6.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of North Carolina at Chapel Hill Curated by ChEMBL					Assay Description Antagonist activity at recombinant human N-terminal His-tagged CBX4 chromodomain (8 to 65 residues) expressed in Escherichia coli Rosetta BL21(DE3)pL...				J Med Chem 59: 8913-8923 (2016) Article DOI: 10.1021/acs.jmedchem.6b00801 BindingDB Entry DOI: 10.7270/Q2H1340D
					More data for this Ligand-Target Pair
Chromobox protein homolog 8 (Homo sapiens (Human))	BDBM50194431 (CHEMBL3954152) Show SMILES COC(=O)[C@H](CO)NC(=O)[C@H](CCCCN(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)c1ccccc1 |r| Show InChI InChI=1S/C39H57N7O9/c1-25(2)21-30(38(53)43-29(19-13-14-20-46(4)5)36(51)45-32(24-47)39(54)55-6)44-34(49)26(3)41-37(52)31(22-27-15-9-7-10-16-27)42-33(48)23-40-35(50)28-17-11-8-12-18-28/h7-12,15-18,25-26,29-32,47H,13-14,19-24H2,1-6H3,(H,40,50)(H,41,52)(H,42,48)(H,43,53)(H,44,49)(H,45,51)/t26-,29-,30-,31-,32-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>6.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of North Carolina at Chapel Hill Curated by ChEMBL					Assay Description Antagonist activity at recombinant human N-terminal His-tagged CBX8 chromodomain (8 to 61 residues) expressed in Escherichia coli Rosetta BL21(DE3)pL...				J Med Chem 59: 8913-8923 (2016) Article DOI: 10.1021/acs.jmedchem.6b00801 BindingDB Entry DOI: 10.7270/Q2H1340D
					More data for this Ligand-Target Pair
Chromobox protein homolog 7 (Homo sapiens (Human))	BDBM50194431 (CHEMBL3954152) Show SMILES COC(=O)[C@H](CO)NC(=O)[C@H](CCCCN(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)c1ccccc1 |r| Show InChI InChI=1S/C39H57N7O9/c1-25(2)21-30(38(53)43-29(19-13-14-20-46(4)5)36(51)45-32(24-47)39(54)55-6)44-34(49)26(3)41-37(52)31(22-27-15-9-7-10-16-27)42-33(48)23-40-35(50)28-17-11-8-12-18-28/h7-12,15-18,25-26,29-32,47H,13-14,19-24H2,1-6H3,(H,40,50)(H,41,52)(H,42,48)(H,43,53)(H,44,49)(H,45,51)/t26-,29-,30-,31-,32-/m0/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of North Carolina at Chapel Hill Curated by ChEMBL					Assay Description Antagonist activity at recombinant human C-terminal His-tagged CBX7 chromodomain (8 to 62 residues) expressed in Escherichia coli Rosetta BL21(DE3)pL...				J Med Chem 59: 8913-8923 (2016) Article DOI: 10.1021/acs.jmedchem.6b00801 BindingDB Entry DOI: 10.7270/Q2H1340D
					More data for this Ligand-Target Pair
Chromodomain Y-like protein 2 (Homo sapiens (Human))	BDBM50194431 (CHEMBL3954152) Show SMILES COC(=O)[C@H](CO)NC(=O)[C@H](CCCCN(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)c1ccccc1 |r| Show InChI InChI=1S/C39H57N7O9/c1-25(2)21-30(38(53)43-29(19-13-14-20-46(4)5)36(51)45-32(24-47)39(54)55-6)44-34(49)26(3)41-37(52)31(22-27-15-9-7-10-16-27)42-33(48)23-40-35(50)28-17-11-8-12-18-28/h7-12,15-18,25-26,29-32,47H,13-14,19-24H2,1-6H3,(H,40,50)(H,41,52)(H,42,48)(H,43,53)(H,44,49)(H,45,51)/t26-,29-,30-,31-,32-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of North Carolina at Chapel Hill Curated by ChEMBL					Assay Description Antagonist activity at recombinant human C-terminal His-tagged CDYL2 chromodomain (1 to 75 residues) expressed in Escherichia coli Rosetta BL21(DE3)p...				J Med Chem 59: 8913-8923 (2016) Article DOI: 10.1021/acs.jmedchem.6b00801 BindingDB Entry DOI: 10.7270/Q2H1340D
					More data for this Ligand-Target Pair
Chromobox protein homolog 5 (Homo sapiens (Human))	BDBM50194431 (CHEMBL3954152) Show SMILES COC(=O)[C@H](CO)NC(=O)[C@H](CCCCN(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)c1ccccc1 |r| Show InChI InChI=1S/C39H57N7O9/c1-25(2)21-30(38(53)43-29(19-13-14-20-46(4)5)36(51)45-32(24-47)39(54)55-6)44-34(49)26(3)41-37(52)31(22-27-15-9-7-10-16-27)42-33(48)23-40-35(50)28-17-11-8-12-18-28/h7-12,15-18,25-26,29-32,47H,13-14,19-24H2,1-6H3,(H,40,50)(H,41,52)(H,42,48)(H,43,53)(H,44,49)(H,45,51)/t26-,29-,30-,31-,32-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>6.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of North Carolina at Chapel Hill Curated by ChEMBL					Assay Description Antagonist activity at recombinant human N-terminal His-tagged CBX5 chromodomain (18 to 75 residues) expressed in Escherichia coli Rosetta BL21(DE3)p...				J Med Chem 59: 8913-8923 (2016) Article DOI: 10.1021/acs.jmedchem.6b00801 BindingDB Entry DOI: 10.7270/Q2H1340D
					More data for this Ligand-Target Pair