Found 3 hits for monomerid = 50195134 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)) | BDBM50195134
((S)-N-(1,8-dioxo-1-(2-(2-phenyl-1H-indol-3-yl)ethy...)Show SMILES CC(=O)CCCCC[C@H](NC(=O)c1cncs1)C(=O)NCCc1c([nH]c2ccccc12)-c1ccccc1 Show InChI InChI=1S/C29H32N4O3S/c1-20(34)10-4-2-7-15-25(33-29(36)26-18-30-19-37-26)28(35)31-17-16-23-22-13-8-9-14-24(22)32-27(23)21-11-5-3-6-12-21/h3,5-6,8-9,11-14,18-19,25,32H,2,4,7,10,15-17H2,1H3,(H,31,35)(H,33,36)/t25-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 590 | n/a | n/a | n/a | n/a | n/a | n/a |
IRBM/Merck Research Laboratories
Curated by ChEMBL
| Assay Description
Inhibition of HDAC1 (mean IC50) |
Bioorg Med Chem Lett 16: 5948-52 (2006)
Article DOI: 10.1016/j.bmcl.2006.09.002
BindingDB Entry DOI: 10.7270/Q2RN38PD |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50195134
((S)-N-(1,8-dioxo-1-(2-(2-phenyl-1H-indol-3-yl)ethy...)Show SMILES CC(=O)CCCCC[C@H](NC(=O)c1cncs1)C(=O)NCCc1c([nH]c2ccccc12)-c1ccccc1 Show InChI InChI=1S/C29H32N4O3S/c1-20(34)10-4-2-7-15-25(33-29(36)26-18-30-19-37-26)28(35)31-17-16-23-22-13-8-9-14-24(22)32-27(23)21-11-5-3-6-12-21/h3,5-6,8-9,11-14,18-19,25,32H,2,4,7,10,15-17H2,1H3,(H,31,35)(H,33,36)/t25-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Menarini Ricerche
Curated by ChEMBL
| Assay Description
Inhibition of HDAC1 from human HeLa cells |
J Med Chem 51: 1505-29 (2008)
Article DOI: 10.1021/jm7011408
BindingDB Entry DOI: 10.7270/Q2M32WMT |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50195134
((S)-N-(1,8-dioxo-1-(2-(2-phenyl-1H-indol-3-yl)ethy...)Show SMILES CC(=O)CCCCC[C@H](NC(=O)c1cncs1)C(=O)NCCc1c([nH]c2ccccc12)-c1ccccc1 Show InChI InChI=1S/C29H32N4O3S/c1-20(34)10-4-2-7-15-25(33-29(36)26-18-30-19-37-26)28(35)31-17-16-23-22-13-8-9-14-24(22)32-27(23)21-11-5-3-6-12-21/h3,5-6,8-9,11-14,18-19,25,32H,2,4,7,10,15-17H2,1H3,(H,31,35)(H,33,36)/t25-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 590 | n/a | n/a | n/a | n/a | n/a | n/a |
Menarini Ricerche
Curated by ChEMBL
| Assay Description
Inhibition of human HDAC1 |
J Med Chem 51: 1505-29 (2008)
Article DOI: 10.1021/jm7011408
BindingDB Entry DOI: 10.7270/Q2M32WMT |
More data for this
Ligand-Target Pair | |
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