Found 5 hits of ic50 for monomerid = 50209798 Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kJ/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
Histone deacetylase 3
(Homo sapiens (Human)) | BDBM50209798
(CHEMBL3884552)Show SMILES COC(=O)Cc1c(C)n(Cc2ccc(cc2)-c2cn(CCCCCC(=O)NO)nn2)c2ccc(OC)cc12 Show InChI InChI=1S/C28H33N5O5/c1-19-23(16-28(35)38-3)24-15-22(37-2)12-13-26(24)33(19)17-20-8-10-21(11-9-20)25-18-32(31-29-25)14-6-4-5-7-27(34)30-36/h8-13,15,18,36H,4-7,14,16-17H2,1-3H3,(H,30,34) | 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 | 224 | n/a | n/a | n/a | n/a | n/a | n/a |
Georgia Institute of Technology
Curated by ChEMBL
| Assay Description Inhibition of HDAC3 (unknown origin) after 5 hrs by SAMDI mass spectroscopic analysis |
Bioorg Med Chem 25: 1202-1218 (2017)
Article DOI: 10.1016/j.bmc.2016.12.032 BindingDB Entry DOI: 10.7270/Q2F76FJW |
More data for this Ligand-Target Pair | |
Histone deacetylase 8
(Homo sapiens (Human)) | BDBM50209798
(CHEMBL3884552)Show SMILES COC(=O)Cc1c(C)n(Cc2ccc(cc2)-c2cn(CCCCCC(=O)NO)nn2)c2ccc(OC)cc12 Show InChI InChI=1S/C28H33N5O5/c1-19-23(16-28(35)38-3)24-15-22(37-2)12-13-26(24)33(19)17-20-8-10-21(11-9-20)25-18-32(31-29-25)14-6-4-5-7-27(34)30-36/h8-13,15,18,36H,4-7,14,16-17H2,1-3H3,(H,30,34) | 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 | 672 | n/a | n/a | n/a | n/a | n/a | n/a |
Georgia Institute of Technology
Curated by ChEMBL
| Assay Description Inhibition of HDAC8 (unknown origin) after 2.5 hrs by SAMDI mass spectroscopic analysis |
Bioorg Med Chem 25: 1202-1218 (2017)
Article DOI: 10.1016/j.bmc.2016.12.032 BindingDB Entry DOI: 10.7270/Q2F76FJW |
More data for this Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50209798
(CHEMBL3884552)Show SMILES COC(=O)Cc1c(C)n(Cc2ccc(cc2)-c2cn(CCCCCC(=O)NO)nn2)c2ccc(OC)cc12 Show InChI InChI=1S/C28H33N5O5/c1-19-23(16-28(35)38-3)24-15-22(37-2)12-13-26(24)33(19)17-20-8-10-21(11-9-20)25-18-32(31-29-25)14-6-4-5-7-27(34)30-36/h8-13,15,18,36H,4-7,14,16-17H2,1-3H3,(H,30,34) | 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 | 778 | n/a | n/a | n/a | n/a | n/a | n/a |
Georgia Institute of Technology
Curated by ChEMBL
| Assay Description Inhibition of HDAC1 (unknown origin) after 24 hrs by SAMDI mass spectroscopic analysis |
Bioorg Med Chem 25: 1202-1218 (2017)
Article DOI: 10.1016/j.bmc.2016.12.032 BindingDB Entry DOI: 10.7270/Q2F76FJW |
More data for this Ligand-Target Pair | |
Histone deacetylase 2
(Homo sapiens (Human)) | BDBM50209798
(CHEMBL3884552)Show SMILES COC(=O)Cc1c(C)n(Cc2ccc(cc2)-c2cn(CCCCCC(=O)NO)nn2)c2ccc(OC)cc12 Show InChI InChI=1S/C28H33N5O5/c1-19-23(16-28(35)38-3)24-15-22(37-2)12-13-26(24)33(19)17-20-8-10-21(11-9-20)25-18-32(31-29-25)14-6-4-5-7-27(34)30-36/h8-13,15,18,36H,4-7,14,16-17H2,1-3H3,(H,30,34) | 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 | 1.36E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Georgia Institute of Technology
Curated by ChEMBL
| Assay Description Inhibition of HDAC2 (unknown origin) after 24 hrs by SAMDI mass spectroscopic analysis |
Bioorg Med Chem 25: 1202-1218 (2017)
Article DOI: 10.1016/j.bmc.2016.12.032 BindingDB Entry DOI: 10.7270/Q2F76FJW |
More data for this Ligand-Target Pair | |
Histone deacetylase 6
(Homo sapiens (Human)) | BDBM50209798
(CHEMBL3884552)Show SMILES COC(=O)Cc1c(C)n(Cc2ccc(cc2)-c2cn(CCCCCC(=O)NO)nn2)c2ccc(OC)cc12 Show InChI InChI=1S/C28H33N5O5/c1-19-23(16-28(35)38-3)24-15-22(37-2)12-13-26(24)33(19)17-20-8-10-21(11-9-20)25-18-32(31-29-25)14-6-4-5-7-27(34)30-36/h8-13,15,18,36H,4-7,14,16-17H2,1-3H3,(H,30,34) | 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 | 6.83E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Georgia Institute of Technology
Curated by ChEMBL
| Assay Description Inhibition of HDAC6 (unknown origin) after 20 hrs by SAMDI mass spectroscopic analysis |
Bioorg Med Chem 25: 1202-1218 (2017)
Article DOI: 10.1016/j.bmc.2016.12.032 BindingDB Entry DOI: 10.7270/Q2F76FJW |
More data for this Ligand-Target Pair | |