BDBM50194426 CHEMBL3906755

SMILES: COC(=O)[C@H](CO)NC(=O)[C@H](CCCCNC1CCCCC1)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=UJGOCBZRZNGGDO-JCXBGQGISA-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 = 50194426   

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))	BDBM50194426 (CHEMBL3906755) Show SMILES COC(=O)[C@H](CO)NC(=O)[C@H](CCCCNC1CCCCC1)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/C43H63N7O9/c1-28(2)24-34(42(57)48-33(40(55)50-36(27-51)43(58)59-4)22-14-15-23-44-32-20-12-7-13-21-32)49-38(53)29(3)46-41(56)35(25-30-16-8-5-9-17-30)47-37(52)26-45-39(54)31-18-10-6-11-19-31/h5-6,8-11,16-19,28-29,32-36,44,51H,7,12-15,20-27H2,1-4H3,(H,45,54)(H,46,56)(H,47,52)(H,48,57)(H,49,53)(H,50,55)/t29-,33-,34-,35-,36-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL 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 5 (Homo sapiens (Human))	BDBM50194426 (CHEMBL3906755) Show SMILES COC(=O)[C@H](CO)NC(=O)[C@H](CCCCNC1CCCCC1)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/C43H63N7O9/c1-28(2)24-34(42(57)48-33(40(55)50-36(27-51)43(58)59-4)22-14-15-23-44-32-20-12-7-13-21-32)49-38(53)29(3)46-41(56)35(25-30-16-8-5-9-17-30)47-37(52)26-45-39(54)31-18-10-6-11-19-31/h5-6,8-11,16-19,28-29,32-36,44,51H,7,12-15,20-27H2,1-4H3,(H,45,54)(H,46,56)(H,47,52)(H,48,57)(H,49,53)(H,50,55)/t29-,33-,34-,35-,36-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL 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
Chromobox protein homolog 7 (Homo sapiens (Human))	BDBM50194426 (CHEMBL3906755) Show SMILES COC(=O)[C@H](CO)NC(=O)[C@H](CCCCNC1CCCCC1)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/C43H63N7O9/c1-28(2)24-34(42(57)48-33(40(55)50-36(27-51)43(58)59-4)22-14-15-23-44-32-20-12-7-13-21-32)49-38(53)29(3)46-41(56)35(25-30-16-8-5-9-17-30)47-37(52)26-45-39(54)31-18-10-6-11-19-31/h5-6,8-11,16-19,28-29,32-36,44,51H,7,12-15,20-27H2,1-4H3,(H,45,54)(H,46,56)(H,47,52)(H,48,57)(H,49,53)(H,50,55)/t29-,33-,34-,35-,36-/m0/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL 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 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))	BDBM50194426 (CHEMBL3906755) Show SMILES COC(=O)[C@H](CO)NC(=O)[C@H](CCCCNC1CCCCC1)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/C43H63N7O9/c1-28(2)24-34(42(57)48-33(40(55)50-36(27-51)43(58)59-4)22-14-15-23-44-32-20-12-7-13-21-32)49-38(53)29(3)46-41(56)35(25-30-16-8-5-9-17-30)47-37(52)26-45-39(54)31-18-10-6-11-19-31/h5-6,8-11,16-19,28-29,32-36,44,51H,7,12-15,20-27H2,1-4H3,(H,45,54)(H,46,56)(H,47,52)(H,48,57)(H,49,53)(H,50,55)/t29-,33-,34-,35-,36-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.70E+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 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 8 (Homo sapiens (Human))	BDBM50194426 (CHEMBL3906755) Show SMILES COC(=O)[C@H](CO)NC(=O)[C@H](CCCCNC1CCCCC1)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/C43H63N7O9/c1-28(2)24-34(42(57)48-33(40(55)50-36(27-51)43(58)59-4)22-14-15-23-44-32-20-12-7-13-21-32)49-38(53)29(3)46-41(56)35(25-30-16-8-5-9-17-30)47-37(52)26-45-39(54)31-18-10-6-11-19-31/h5-6,8-11,16-19,28-29,32-36,44,51H,7,12-15,20-27H2,1-4H3,(H,45,54)(H,46,56)(H,47,52)(H,48,57)(H,49,53)(H,50,55)/t29-,33-,34-,35-,36-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL 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