Found 10 hits with Last Name = 'padilla-coley' and Initial = 's' 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 6
(Homo sapiens (Human)) | BDBM50507257
(CHEMBL4475116)Show SMILES CCCNc1ccc2C(=O)N(CCCCCC(=O)NO)C(=O)c3cccc1c23 Show InChI InChI=1S/C21H25N3O4/c1-2-12-22-17-11-10-16-19-14(17)7-6-8-15(19)20(26)24(21(16)27)13-5-3-4-9-18(25)23-28/h6-8,10-11,22,28H,2-5,9,12-13H2,1H3,(H,23,25) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 4.80 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of HDAC6 (unknown origin) |
Citation and Details
Article DOI: 10.1016/j.bmcl.2021.128207 BindingDB Entry DOI: 10.7270/Q25D8WP2 |
More data for this Ligand-Target Pair | |
Histone deacetylase 6
(Homo sapiens (Human)) | BDBM50398716
(CHEMBL2179618 | US10227295, Compound 5g | US940985...)Show InChI InChI=1S/C19H23N3O3/c1-2-3-13-22(19(24)20-17-7-5-4-6-8-17)14-15-9-11-16(12-10-15)18(23)21-25/h4-12,25H,2-3,13-14H2,1H3,(H,20,24)(H,21,23) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE PC cid PC sid PDB UniChem
Similars
| Article PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of HDAC6 (unknown origin) |
Citation and Details
Article DOI: 10.1016/j.bmcl.2021.128207 BindingDB Entry DOI: 10.7270/Q25D8WP2 |
More data for this Ligand-Target Pair | |
Histone deacetylase 6
(Homo sapiens (Human)) | BDBM50576424
(CHEMBL4864538)Show SMILES ONC(=O)CCCCCN1C(=O)c2cccc3c(OCc4ccc(cc4)C(F)(F)F)ccc(C1=O)c23 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of HDAC6 (unknown origin) |
Citation and Details
Article DOI: 10.1016/j.bmcl.2021.128207 BindingDB Entry DOI: 10.7270/Q25D8WP2 |
More data for this Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM19149
(CHEMBL98 | N-hydroxy-N'-phenyloctanediamide | SAHA...)Show InChI InChI=1S/C14H20N2O3/c17-13(15-12-8-4-3-5-9-12)10-6-1-2-7-11-14(18)16-19/h3-5,8-9,19H,1-2,6-7,10-11H2,(H,15,17)(H,16,18) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem
Patents
Similars
| DrugBank PDB Article PubMed
| n/a | n/a | 33 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of HDAC1 (unknown origin) |
Citation and Details
Article DOI: 10.1016/j.bmcl.2021.128207 BindingDB Entry DOI: 10.7270/Q25D8WP2 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Histone deacetylase 6
(Homo sapiens (Human)) | BDBM19149
(CHEMBL98 | N-hydroxy-N'-phenyloctanediamide | SAHA...)Show InChI InChI=1S/C14H20N2O3/c17-13(15-12-8-4-3-5-9-12)10-6-1-2-7-11-14(18)16-19/h3-5,8-9,19H,1-2,6-7,10-11H2,(H,15,17)(H,16,18) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem
Patents
Similars
| DrugBank Article PubMed
| n/a | n/a | 33 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of HDAC6 (unknown origin) |
Citation and Details
Article DOI: 10.1016/j.bmcl.2021.128207 BindingDB Entry DOI: 10.7270/Q25D8WP2 |
More data for this Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50576424
(CHEMBL4864538)Show SMILES ONC(=O)CCCCCN1C(=O)c2cccc3c(OCc4ccc(cc4)C(F)(F)F)ccc(C1=O)c23 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 280 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of HDAC1 (unknown origin) |
Citation and Details
Article DOI: 10.1016/j.bmcl.2021.128207 BindingDB Entry DOI: 10.7270/Q25D8WP2 |
More data for this Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50507257
(CHEMBL4475116)Show SMILES CCCNc1ccc2C(=O)N(CCCCCC(=O)NO)C(=O)c3cccc1c23 Show InChI InChI=1S/C21H25N3O4/c1-2-12-22-17-11-10-16-19-14(17)7-6-8-15(19)20(26)24(21(16)27)13-5-3-4-9-18(25)23-28/h6-8,10-11,22,28H,2-5,9,12-13H2,1H3,(H,23,25) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 590 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of HDAC1 (unknown origin) |
Citation and Details
Article DOI: 10.1016/j.bmcl.2021.128207 BindingDB Entry DOI: 10.7270/Q25D8WP2 |
More data for this Ligand-Target Pair | |
Histone deacetylase 6
(Homo sapiens (Human)) | BDBM50576425
(CHEMBL4866882)Show SMILES CCCNc1ccc2C(=O)N(CCCC(=O)NO)C(=O)c3cccc1c23 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 1.12E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of HDAC6 (unknown origin) |
Citation and Details
Article DOI: 10.1016/j.bmcl.2021.128207 BindingDB Entry DOI: 10.7270/Q25D8WP2 |
More data for this Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50398716
(CHEMBL2179618 | US10227295, Compound 5g | US940985...)Show InChI InChI=1S/C19H23N3O3/c1-2-3-13-22(19(24)20-17-7-5-4-6-8-17)14-15-9-11-16(12-10-15)18(23)21-25/h4-12,25H,2-3,13-14H2,1H3,(H,20,24)(H,21,23) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE PC cid PC sid PDB UniChem
Similars
| Article PubMed
| n/a | n/a | 3.02E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of HDAC1 (unknown origin) |
Citation and Details
Article DOI: 10.1016/j.bmcl.2021.128207 BindingDB Entry DOI: 10.7270/Q25D8WP2 |
More data for this Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50576425
(CHEMBL4866882)Show SMILES CCCNc1ccc2C(=O)N(CCCC(=O)NO)C(=O)c3cccc1c23 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 9.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of HDAC1 (unknown origin) |
Citation and Details
Article DOI: 10.1016/j.bmcl.2021.128207 BindingDB Entry DOI: 10.7270/Q25D8WP2 |
More data for this Ligand-Target Pair | |