Found 15 hits for monomerid = 50264803 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 |
|---|
Diacylglycerol O-acyltransferase 1 (DGAT1)
(Homo sapiens (Human)) | BDBM50264803
(CHEMBL4075203)Show SMILES OC(=O)CC1CCOC2(CCN(CC2)c2ccc(cn2)-c2nc3cc(ccc3[nH]2)C(F)(F)F)C1 Show InChI InChI=1S/C24H25F3N4O3/c25-24(26,27)17-2-3-18-19(12-17)30-22(29-18)16-1-4-20(28-14-16)31-8-6-23(7-9-31)13-15(5-10-34-23)11-21(32)33/h1-4,12,14-15H,5-11,13H2,(H,29,30)(H,32,33) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 73 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co., Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human DGAT1 expressed in yeast membrane fraction assessed as inhibition of triglyceride formation using diolein/oleoyl-CoA as substrate... |
J Med Chem 60: 3594-3605 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01543
BindingDB Entry DOI: 10.7270/Q290267S |
More data for this
Ligand-Target Pair | |
Diacylglycerol O-acyltransferase 1 (DGAT1)
(Homo sapiens (Human)) | BDBM50264803
(CHEMBL4075203)Show SMILES OC(=O)CC1CCOC2(CCN(CC2)c2ccc(cn2)-c2nc3cc(ccc3[nH]2)C(F)(F)F)C1 Show InChI InChI=1S/C24H25F3N4O3/c25-24(26,27)17-2-3-18-19(12-17)30-22(29-18)16-1-4-20(28-14-16)31-8-6-23(7-9-31)13-15(5-10-34-23)11-21(32)33/h1-4,12,14-15H,5-11,13H2,(H,29,30)(H,32,33) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co., Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human DGAT1 expressed in yeast membrane fraction assessed as inhibition of triglyceride formation using diolein/oleoyl-CoA as substrate... |
J Med Chem 60: 3594-3605 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01543
BindingDB Entry DOI: 10.7270/Q290267S |
More data for this
Ligand-Target Pair | |
Cytochrome P450 2C9
(Homo sapiens (Human)) | BDBM50264803
(CHEMBL4075203)Show SMILES OC(=O)CC1CCOC2(CCN(CC2)c2ccc(cn2)-c2nc3cc(ccc3[nH]2)C(F)(F)F)C1 Show InChI InChI=1S/C24H25F3N4O3/c25-24(26,27)17-2-3-18-19(12-17)30-22(29-18)16-1-4-20(28-14-16)31-8-6-23(7-9-31)13-15(5-10-34-23)11-21(32)33/h1-4,12,14-15H,5-11,13H2,(H,29,30)(H,32,33) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co., Inc.
Curated by ChEMBL
| Assay Description
Inhibition of CYP2C9 (unknown origin) |
J Med Chem 60: 3594-3605 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01543
BindingDB Entry DOI: 10.7270/Q290267S |
More data for this
Ligand-Target Pair | |
Cytochrome P450 2C9
(Homo sapiens (Human)) | BDBM50264803
(CHEMBL4075203)Show SMILES OC(=O)CC1CCOC2(CCN(CC2)c2ccc(cn2)-c2nc3cc(ccc3[nH]2)C(F)(F)F)C1 Show InChI InChI=1S/C24H25F3N4O3/c25-24(26,27)17-2-3-18-19(12-17)30-22(29-18)16-1-4-20(28-14-16)31-8-6-23(7-9-31)13-15(5-10-34-23)11-21(32)33/h1-4,12,14-15H,5-11,13H2,(H,29,30)(H,32,33) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 4.52E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co., Inc.
Curated by ChEMBL
| Assay Description
Inhibition of CYP2C9 (unknown origin) |
J Med Chem 60: 3594-3605 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01543
BindingDB Entry DOI: 10.7270/Q290267S |
More data for this
Ligand-Target Pair | |
Cytochrome P450 2C9
(Homo sapiens (Human)) | BDBM50264803
(CHEMBL4075203)Show SMILES OC(=O)CC1CCOC2(CCN(CC2)c2ccc(cn2)-c2nc3cc(ccc3[nH]2)C(F)(F)F)C1 Show InChI InChI=1S/C24H25F3N4O3/c25-24(26,27)17-2-3-18-19(12-17)30-22(29-18)16-1-4-20(28-14-16)31-8-6-23(7-9-31)13-15(5-10-34-23)11-21(32)33/h1-4,12,14-15H,5-11,13H2,(H,29,30)(H,32,33) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 3.51E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co., Inc.
Curated by ChEMBL
| Assay Description
Inhibition of CYP2C9 (unknown origin) |
J Med Chem 60: 3594-3605 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01543
BindingDB Entry DOI: 10.7270/Q290267S |
More data for this
Ligand-Target Pair | |
1,3-beta-glucan synthase component GLS2
(Saccharomyces cerevisiae) | BDBM50264803
(CHEMBL4075203)Show SMILES OC(=O)CC1CCOC2(CCN(CC2)c2ccc(cn2)-c2nc3cc(ccc3[nH]2)C(F)(F)F)C1 Show InChI InChI=1S/C24H25F3N4O3/c25-24(26,27)17-2-3-18-19(12-17)30-22(29-18)16-1-4-20(28-14-16)31-8-6-23(7-9-31)13-15(5-10-34-23)11-21(32)33/h1-4,12,14-15H,5-11,13H2,(H,29,30)(H,32,33) | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 4.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co., Inc.
Curated by ChEMBL
| Assay Description
Inhibition of MK499 binding to human ERG |
J Med Chem 60: 3594-3605 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01543
BindingDB Entry DOI: 10.7270/Q290267S |
More data for this
Ligand-Target Pair | |
1,3-beta-glucan synthase component GLS2
(Saccharomyces cerevisiae) | BDBM50264803
(CHEMBL4075203)Show SMILES OC(=O)CC1CCOC2(CCN(CC2)c2ccc(cn2)-c2nc3cc(ccc3[nH]2)C(F)(F)F)C1 Show InChI InChI=1S/C24H25F3N4O3/c25-24(26,27)17-2-3-18-19(12-17)30-22(29-18)16-1-4-20(28-14-16)31-8-6-23(7-9-31)13-15(5-10-34-23)11-21(32)33/h1-4,12,14-15H,5-11,13H2,(H,29,30)(H,32,33) | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co., Inc.
Curated by ChEMBL
| Assay Description
Inhibition of MK499 binding to human ERG |
J Med Chem 60: 3594-3605 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01543
BindingDB Entry DOI: 10.7270/Q290267S |
More data for this
Ligand-Target Pair | |
1,3-beta-glucan synthase component GLS2
(Saccharomyces cerevisiae) | BDBM50264803
(CHEMBL4075203)Show SMILES OC(=O)CC1CCOC2(CCN(CC2)c2ccc(cn2)-c2nc3cc(ccc3[nH]2)C(F)(F)F)C1 Show InChI InChI=1S/C24H25F3N4O3/c25-24(26,27)17-2-3-18-19(12-17)30-22(29-18)16-1-4-20(28-14-16)31-8-6-23(7-9-31)13-15(5-10-34-23)11-21(32)33/h1-4,12,14-15H,5-11,13H2,(H,29,30)(H,32,33) | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 6.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co., Inc.
Curated by ChEMBL
| Assay Description
Inhibition of MK499 binding to human ERG |
J Med Chem 60: 3594-3605 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01543
BindingDB Entry DOI: 10.7270/Q290267S |
More data for this
Ligand-Target Pair | |
Cytochrome P450 3A4
(Homo sapiens (Human)) | BDBM50264803
(CHEMBL4075203)Show SMILES OC(=O)CC1CCOC2(CCN(CC2)c2ccc(cn2)-c2nc3cc(ccc3[nH]2)C(F)(F)F)C1 Show InChI InChI=1S/C24H25F3N4O3/c25-24(26,27)17-2-3-18-19(12-17)30-22(29-18)16-1-4-20(28-14-16)31-8-6-23(7-9-31)13-15(5-10-34-23)11-21(32)33/h1-4,12,14-15H,5-11,13H2,(H,29,30)(H,32,33) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co., Inc.
Curated by ChEMBL
| Assay Description
Inhibition of CYP3A4 (unknown origin) |
J Med Chem 60: 3594-3605 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01543
BindingDB Entry DOI: 10.7270/Q290267S |
More data for this
Ligand-Target Pair | |
Pregnane X receptor
(Homo sapiens (Human)) | BDBM50264803
(CHEMBL4075203)Show SMILES OC(=O)CC1CCOC2(CCN(CC2)c2ccc(cn2)-c2nc3cc(ccc3[nH]2)C(F)(F)F)C1 Show InChI InChI=1S/C24H25F3N4O3/c25-24(26,27)17-2-3-18-19(12-17)30-22(29-18)16-1-4-20(28-14-16)31-8-6-23(7-9-31)13-15(5-10-34-23)11-21(32)33/h1-4,12,14-15H,5-11,13H2,(H,29,30)(H,32,33) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co., Inc.
Curated by ChEMBL
| Assay Description
Inhibition of PXR (unknown origin) |
J Med Chem 60: 3594-3605 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01543
BindingDB Entry DOI: 10.7270/Q290267S |
More data for this
Ligand-Target Pair | |
Cytochrome P450 3A4
(Homo sapiens (Human)) | BDBM50264803
(CHEMBL4075203)Show SMILES OC(=O)CC1CCOC2(CCN(CC2)c2ccc(cn2)-c2nc3cc(ccc3[nH]2)C(F)(F)F)C1 Show InChI InChI=1S/C24H25F3N4O3/c25-24(26,27)17-2-3-18-19(12-17)30-22(29-18)16-1-4-20(28-14-16)31-8-6-23(7-9-31)13-15(5-10-34-23)11-21(32)33/h1-4,12,14-15H,5-11,13H2,(H,29,30)(H,32,33) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co., Inc.
Curated by ChEMBL
| Assay Description
Inhibition of CYP3A4 (unknown origin) |
J Med Chem 60: 3594-3605 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01543
BindingDB Entry DOI: 10.7270/Q290267S |
More data for this
Ligand-Target Pair | |
Cytochrome P450 3A4
(Homo sapiens (Human)) | BDBM50264803
(CHEMBL4075203)Show SMILES OC(=O)CC1CCOC2(CCN(CC2)c2ccc(cn2)-c2nc3cc(ccc3[nH]2)C(F)(F)F)C1 Show InChI InChI=1S/C24H25F3N4O3/c25-24(26,27)17-2-3-18-19(12-17)30-22(29-18)16-1-4-20(28-14-16)31-8-6-23(7-9-31)13-15(5-10-34-23)11-21(32)33/h1-4,12,14-15H,5-11,13H2,(H,29,30)(H,32,33) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co., Inc.
Curated by ChEMBL
| Assay Description
Inhibition of CYP3A4 (unknown origin) |
J Med Chem 60: 3594-3605 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01543
BindingDB Entry DOI: 10.7270/Q290267S |
More data for this
Ligand-Target Pair | |
Pregnane X receptor
(Homo sapiens (Human)) | BDBM50264803
(CHEMBL4075203)Show SMILES OC(=O)CC1CCOC2(CCN(CC2)c2ccc(cn2)-c2nc3cc(ccc3[nH]2)C(F)(F)F)C1 Show InChI InChI=1S/C24H25F3N4O3/c25-24(26,27)17-2-3-18-19(12-17)30-22(29-18)16-1-4-20(28-14-16)31-8-6-23(7-9-31)13-15(5-10-34-23)11-21(32)33/h1-4,12,14-15H,5-11,13H2,(H,29,30)(H,32,33) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co., Inc.
Curated by ChEMBL
| Assay Description
Inhibition of PXR (unknown origin) |
J Med Chem 60: 3594-3605 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01543
BindingDB Entry DOI: 10.7270/Q290267S |
More data for this
Ligand-Target Pair | |
Pregnane X receptor
(Homo sapiens (Human)) | BDBM50264803
(CHEMBL4075203)Show SMILES OC(=O)CC1CCOC2(CCN(CC2)c2ccc(cn2)-c2nc3cc(ccc3[nH]2)C(F)(F)F)C1 Show InChI InChI=1S/C24H25F3N4O3/c25-24(26,27)17-2-3-18-19(12-17)30-22(29-18)16-1-4-20(28-14-16)31-8-6-23(7-9-31)13-15(5-10-34-23)11-21(32)33/h1-4,12,14-15H,5-11,13H2,(H,29,30)(H,32,33) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co., Inc.
Curated by ChEMBL
| Assay Description
Inhibition of PXR (unknown origin) |
J Med Chem 60: 3594-3605 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01543
BindingDB Entry DOI: 10.7270/Q290267S |
More data for this
Ligand-Target Pair | |
Diacylglycerol O-acyltransferase 1 (DGAT1)
(Homo sapiens (Human)) | BDBM50264803
(CHEMBL4075203)Show SMILES OC(=O)CC1CCOC2(CCN(CC2)c2ccc(cn2)-c2nc3cc(ccc3[nH]2)C(F)(F)F)C1 Show InChI InChI=1S/C24H25F3N4O3/c25-24(26,27)17-2-3-18-19(12-17)30-22(29-18)16-1-4-20(28-14-16)31-8-6-23(7-9-31)13-15(5-10-34-23)11-21(32)33/h1-4,12,14-15H,5-11,13H2,(H,29,30)(H,32,33) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 65 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck& Co., Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human DGAT1 expressed in yeast membrane fraction assessed as inhibition of triglyceride formation using diolein/oleoyl-CoA as substrate... |
J Med Chem 60: 3594-3605 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01543
BindingDB Entry DOI: 10.7270/Q290267S |
More data for this
Ligand-Target Pair | |
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