BDBM50137850 6-(5,7-Dioxo-5,7-dihydro-pyrrolo[3,4-b]pyridin-6-yl)-hexanoic acid (2-amino-phenyl)-amide::CHEMBL97061
SMILES: Nc1ccccc1NC(=O)CCCCCN1C(=O)c2cccnc2C1=O
InChI Key: InChIKey=YJZJTIDKFBOCHJ-UHFFFAOYSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50137850 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
(Homo sapiens (Human)) | BDBM50137850
(6-(5,7-Dioxo-5,7-dihydro-pyrrolo[3,4-b]pyridin-6-y...)Show InChI InChI=1S/C19H20N4O3/c20-14-8-3-4-9-15(14)22-16(24)10-2-1-5-12-23-18(25)13-7-6-11-21-17(13)19(23)26/h3-4,6-9,11H,1-2,5,10,12,20H2,(H,22,24) | PDB
UniProtKB/SwissProt UniProtKB/TrEMBL
antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
| PubMed
| n/a | n/a | n/a | n/a | >2.50E+4 | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description Effect on induced hyperacetylation of histones in whole cells |
Bioorg Med Chem Lett 14: 283-7 (2003)
BindingDB Entry DOI: 10.7270/Q2BV7G17 |
More data for this Ligand-Target Pair | |
Cereblon/Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50137850
(6-(5,7-Dioxo-5,7-dihydro-pyrrolo[3,4-b]pyridin-6-y...)Show InChI InChI=1S/C19H20N4O3/c20-14-8-3-4-9-15(14)22-16(24)10-2-1-5-12-23-18(25)13-7-6-11-21-17(13)19(23)26/h3-4,6-9,11H,1-2,5,10,12,20H2,(H,22,24) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
| PubMed
| n/a | n/a | 5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description Ability to inhibit recombinant human histone deacetylase 1 (HDAC-1). |
Bioorg Med Chem Lett 14: 283-7 (2003)
BindingDB Entry DOI: 10.7270/Q2BV7G17 |
More data for this Ligand-Target Pair | |