Found 4 hits for monomerid = 50390608 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 |
|---|
Probable G-protein coupled receptor 142
(Homo sapiens (Human)) | BDBM50390608
(CHEMBL2069588)Show SMILES Cc1cc(ccn1)-c1c[nH]c(=O)c(NC(=O)[C@H](Cc2ccccc2)NCc2cscn2)c1 |r| Show InChI InChI=1S/C24H23N5O2S/c1-16-9-18(7-8-25-16)19-11-22(23(30)27-12-19)29-24(31)21(10-17-5-3-2-4-6-17)26-13-20-14-32-15-28-20/h2-9,11-12,14-15,21,26H,10,13H2,1H3,(H,27,30)(H,29,31)/t21-/m0/s1 | KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 67 | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Agonist activity at human GPR142 expressed in HEK293 cells assessed as inositol phosphate accumulation using [3H]-inositol after 1 hr by scintillatio... |
Bioorg Med Chem Lett 22: 5942-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.063
BindingDB Entry DOI: 10.7270/Q2VH5PXT |
More data for this
Ligand-Target Pair | |
Cytochrome P450 2D6
(Homo sapiens (Human)) | BDBM50390608
(CHEMBL2069588)Show SMILES Cc1cc(ccn1)-c1c[nH]c(=O)c(NC(=O)[C@H](Cc2ccccc2)NCc2cscn2)c1 |r| Show InChI InChI=1S/C24H23N5O2S/c1-16-9-18(7-8-25-16)19-11-22(23(30)27-12-19)29-24(31)21(10-17-5-3-2-4-6-17)26-13-20-14-32-15-28-20/h2-9,11-12,14-15,21,26H,10,13H2,1H3,(H,27,30)(H,29,31)/t21-/m0/s1 | PDB
UniProtKB/SwissProt
UniProtKB/TrEMBL
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Inhibition of CYP2D6 |
Bioorg Med Chem Lett 22: 5942-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.063
BindingDB Entry DOI: 10.7270/Q2VH5PXT |
More data for this
Ligand-Target Pair | |
Cytochrome P450 3A4
(Homo sapiens (Human)) | BDBM50390608
(CHEMBL2069588)Show SMILES Cc1cc(ccn1)-c1c[nH]c(=O)c(NC(=O)[C@H](Cc2ccccc2)NCc2cscn2)c1 |r| Show InChI InChI=1S/C24H23N5O2S/c1-16-9-18(7-8-25-16)19-11-22(23(30)27-12-19)29-24(31)21(10-17-5-3-2-4-6-17)26-13-20-14-32-15-28-20/h2-9,11-12,14-15,21,26H,10,13H2,1H3,(H,27,30)(H,29,31)/t21-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Inhibition of CYP3A4 |
Bioorg Med Chem Lett 22: 5942-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.063
BindingDB Entry DOI: 10.7270/Q2VH5PXT |
More data for this
Ligand-Target Pair | |
Probable G-protein coupled receptor 142
(Homo sapiens (Human)) | BDBM50390608
(CHEMBL2069588)Show SMILES Cc1cc(ccn1)-c1c[nH]c(=O)c(NC(=O)[C@H](Cc2ccccc2)NCc2cscn2)c1 |r| Show InChI InChI=1S/C24H23N5O2S/c1-16-9-18(7-8-25-16)19-11-22(23(30)27-12-19)29-24(31)21(10-17-5-3-2-4-6-17)26-13-20-14-32-15-28-20/h2-9,11-12,14-15,21,26H,10,13H2,1H3,(H,27,30)(H,29,31)/t21-/m0/s1 | KEGG
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 290 | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Agonist activity at human GPR142 expressed in HEK293 cells assessed as inositol phosphate accumulation using [3H]-inositol after 1 hr by scintillatio... |
Bioorg Med Chem Lett 22: 5942-7 (2012)
Article DOI: 10.1016/j.bmcl.2012.07.063
BindingDB Entry DOI: 10.7270/Q2VH5PXT |
More data for this
Ligand-Target Pair | |
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