null

SMILES: OC(=O)CCCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)C[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2cccc3ccccc23)NC1=O

InChI Key: InChIKey=VGLDOTYMNLKSIR-AKQLPAHTSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50302060   

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
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50302060 (6-((2S,5S,8S,11S)-11-((1H-indol-3-yl)methyl)-2-ben...) Show SMILES OC(=O)CCCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)C[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2cccc3ccccc23)NC1=O |r| Show InChI InChI=1S/C42H45N5O6/c48-38-25-31(23-30-26-43-34-19-10-9-18-33(30)34)44-41(52)37(24-29-16-11-15-28-14-7-8-17-32(28)29)47-40(51)35(20-5-2-6-21-39(49)50)46-42(53)36(45-38)22-27-12-3-1-4-13-27/h1,3-4,7-19,26,31,35-37,43H,2,5-6,20-25H2,(H,44,52)(H,45,48)(H,46,53)(H,47,51)(H,49,50)/t31-,35-,36-,37-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	460	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of human recombinant HDAC1 after 30 mins by fluorimetric assay				J Med Chem 52: 7836-46 (2009) Article DOI: 10.1021/jm900850t BindingDB Entry DOI: 10.7270/Q2M046DK
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50302060 (6-((2S,5S,8S,11S)-11-((1H-indol-3-yl)methyl)-2-ben...) Show SMILES OC(=O)CCCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)C[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2cccc3ccccc23)NC1=O |r| Show InChI InChI=1S/C42H45N5O6/c48-38-25-31(23-30-26-43-34-19-10-9-18-33(30)34)44-41(52)37(24-29-16-11-15-28-14-7-8-17-32(28)29)47-40(51)35(20-5-2-6-21-39(49)50)46-42(53)36(45-38)22-27-12-3-1-4-13-27/h1,3-4,7-19,26,31,35-37,43H,2,5-6,20-25H2,(H,44,52)(H,45,48)(H,46,53)(H,47,51)(H,49,50)/t31-,35-,36-,37-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of human recombinant HDAC6 after 30 mins by fluorimetric assay				J Med Chem 52: 7836-46 (2009) Article DOI: 10.1021/jm900850t BindingDB Entry DOI: 10.7270/Q2M046DK
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM50302060 (6-((2S,5S,8S,11S)-11-((1H-indol-3-yl)methyl)-2-ben...) Show SMILES OC(=O)CCCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)C[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2cccc3ccccc23)NC1=O |r| Show InChI InChI=1S/C42H45N5O6/c48-38-25-31(23-30-26-43-34-19-10-9-18-33(30)34)44-41(52)37(24-29-16-11-15-28-14-7-8-17-32(28)29)47-40(51)35(20-5-2-6-21-39(49)50)46-42(53)36(45-38)22-27-12-3-1-4-13-27/h1,3-4,7-19,26,31,35-37,43H,2,5-6,20-25H2,(H,44,52)(H,45,48)(H,46,53)(H,47,51)(H,49,50)/t31-,35-,36-,37-/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of human recombinant HDAC3 after 30 mins by fluorimetric assay				J Med Chem 52: 7836-46 (2009) Article DOI: 10.1021/jm900850t BindingDB Entry DOI: 10.7270/Q2M046DK
					More data for this Ligand-Target Pair