Found 5 hits for monomerid = 50199121 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 2
(Homo sapiens (Human)) | BDBM50199121
(CHEMBL3908221)Show SMILES CC1(C)N(C(=S)N(C1=O)c1ccc(C#N)c(c1)C(F)(F)F)c1ccc(C(=O)NCCCCCCc2ccc(s2)C(=O)C(F)(F)F)c(F)c1 Show InChI InChI=1S/C32H27F7N4O3S2/c1-30(2)28(46)42(19-9-8-18(17-40)23(15-19)31(34,35)36)29(47)43(30)20-10-12-22(24(33)16-20)27(45)41-14-6-4-3-5-7-21-11-13-25(48-21)26(44)32(37,38)39/h8-13,15-16H,3-7,14H2,1-2H3,(H,41,45) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Integral BioSciences Pvt. Ltd
Curated by ChEMBL
| Assay Description Inhibition of HDAC2 (unknown origin) assessed as inhibition of fluorogenic peptide deacetylation |
Bioorg Med Chem Lett 26: 5222-5228 (2016)
Article DOI: 10.1016/j.bmcl.2016.09.058 BindingDB Entry DOI: 10.7270/Q29W0HFD |
More data for this Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50199121
(CHEMBL3908221)Show SMILES CC1(C)N(C(=S)N(C1=O)c1ccc(C#N)c(c1)C(F)(F)F)c1ccc(C(=O)NCCCCCCc2ccc(s2)C(=O)C(F)(F)F)c(F)c1 Show InChI InChI=1S/C32H27F7N4O3S2/c1-30(2)28(46)42(19-9-8-18(17-40)23(15-19)31(34,35)36)29(47)43(30)20-10-12-22(24(33)16-20)27(45)41-14-6-4-3-5-7-21-11-13-25(48-21)26(44)32(37,38)39/h8-13,15-16H,3-7,14H2,1-2H3,(H,41,45) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Integral BioSciences Pvt. Ltd
Curated by ChEMBL
| Assay Description Inhibition of HDAC1 (unknown origin) assessed as inhibition of fluorogenic peptide deacetylation |
Bioorg Med Chem Lett 26: 5222-5228 (2016)
Article DOI: 10.1016/j.bmcl.2016.09.058 BindingDB Entry DOI: 10.7270/Q29W0HFD |
More data for this Ligand-Target Pair | |
Cereblon/Histone deacetylase 6
(Homo sapiens (Human)) | BDBM50199121
(CHEMBL3908221)Show SMILES CC1(C)N(C(=S)N(C1=O)c1ccc(C#N)c(c1)C(F)(F)F)c1ccc(C(=O)NCCCCCCc2ccc(s2)C(=O)C(F)(F)F)c(F)c1 Show InChI InChI=1S/C32H27F7N4O3S2/c1-30(2)28(46)42(19-9-8-18(17-40)23(15-19)31(34,35)36)29(47)43(30)20-10-12-22(24(33)16-20)27(45)41-14-6-4-3-5-7-21-11-13-25(48-21)26(44)32(37,38)39/h8-13,15-16H,3-7,14H2,1-2H3,(H,41,45) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Integral BioSciences Pvt. Ltd
Curated by ChEMBL
| Assay Description Inhibition of HDAC6 (unknown origin) assessed as inhibition of fluorogenic peptide deacetylation |
Bioorg Med Chem Lett 26: 5222-5228 (2016)
Article DOI: 10.1016/j.bmcl.2016.09.058 BindingDB Entry DOI: 10.7270/Q29W0HFD |
More data for this Ligand-Target Pair | |
Androgen Receptor
(Homo sapiens (Human)) | BDBM50199121
(CHEMBL3908221)Show SMILES CC1(C)N(C(=S)N(C1=O)c1ccc(C#N)c(c1)C(F)(F)F)c1ccc(C(=O)NCCCCCCc2ccc(s2)C(=O)C(F)(F)F)c(F)c1 Show InChI InChI=1S/C32H27F7N4O3S2/c1-30(2)28(46)42(19-9-8-18(17-40)23(15-19)31(34,35)36)29(47)43(30)20-10-12-22(24(33)16-20)27(45)41-14-6-4-3-5-7-21-11-13-25(48-21)26(44)32(37,38)39/h8-13,15-16H,3-7,14H2,1-2H3,(H,41,45) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 68 | n/a | n/a | n/a | n/a | n/a | n/a |
Integral BioSciences Pvt. Ltd
Curated by ChEMBL
| Assay Description Displacement of [3H]mibolerone from androgen receptor (unknown origin) in membranes after 24 hrs by HAP adsorption assay |
Bioorg Med Chem Lett 26: 5222-5228 (2016)
Article DOI: 10.1016/j.bmcl.2016.09.058 BindingDB Entry DOI: 10.7270/Q29W0HFD |
More data for this Ligand-Target Pair | |
Histone deacetylase 3
(Homo sapiens (Human)) | BDBM50199121
(CHEMBL3908221)Show SMILES CC1(C)N(C(=S)N(C1=O)c1ccc(C#N)c(c1)C(F)(F)F)c1ccc(C(=O)NCCCCCCc2ccc(s2)C(=O)C(F)(F)F)c(F)c1 Show InChI InChI=1S/C32H27F7N4O3S2/c1-30(2)28(46)42(19-9-8-18(17-40)23(15-19)31(34,35)36)29(47)43(30)20-10-12-22(24(33)16-20)27(45)41-14-6-4-3-5-7-21-11-13-25(48-21)26(44)32(37,38)39/h8-13,15-16H,3-7,14H2,1-2H3,(H,41,45) | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Integral BioSciences Pvt. Ltd
Curated by ChEMBL
| Assay Description Inhibition of HDAC3 (unknown origin) assessed as inhibition of fluorogenic peptide deacetylation |
Bioorg Med Chem Lett 26: 5222-5228 (2016)
Article DOI: 10.1016/j.bmcl.2016.09.058 BindingDB Entry DOI: 10.7270/Q29W0HFD |
More data for this Ligand-Target Pair | |