Found 4 hits for monomerid = 50598849 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 |
|---|
Cytochrome P450 2D6
(Homo sapiens (Human)) | BDBM50598849
(CHEMBL5204520)Show SMILES Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)-c1nccs1 |(3.88,-2.75,;4.17,-1.55,;5.65,-1.12,;6.01,.38,;4.9,1.44,;5.19,2.64,;3.42,1.01,;2.53,1.86,;3.06,-.49,;1.55,-.81,;.93,-2.21,;1.54,-3.28,;-.61,-2.05,;-1.63,-3.2,;-2.84,-2.94,;-1.25,-4.37,;-.92,-.55,;-2.26,.22,;-2.26,1.76,;-.92,2.53,;.41,1.76,;.41,.22,;-3.59,2.53,;-3.74,4.05,;-5.24,4.37,;-6.01,3.04,;-4.98,1.89,)| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet 
| Purchase
MCE
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 |
TBA
| |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.2c00552
BindingDB Entry DOI: 10.7270/Q2028WKQ |
More data for this
Ligand-Target Pair | |
Membrane-associated tyrosine- and threonine-specific cdc2-inhibitory kinase
(Homo sapiens (Human)) | BDBM50598849
(CHEMBL5204520)Show SMILES Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)-c1nccs1 |(3.88,-2.75,;4.17,-1.55,;5.65,-1.12,;6.01,.38,;4.9,1.44,;5.19,2.64,;3.42,1.01,;2.53,1.86,;3.06,-.49,;1.55,-.81,;.93,-2.21,;1.54,-3.28,;-.61,-2.05,;-1.63,-3.2,;-2.84,-2.94,;-1.25,-4.37,;-.92,-.55,;-2.26,.22,;-2.26,1.76,;-.92,2.53,;.41,1.76,;.41,.22,;-3.59,2.53,;-3.74,4.05,;-5.24,4.37,;-6.01,3.04,;-4.98,1.89,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| Purchase
MCE
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 34 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.2c00552
BindingDB Entry DOI: 10.7270/Q2028WKQ |
More data for this
Ligand-Target Pair | |
Cytochrome P450 3A4
(Homo sapiens (Human)) | BDBM50598849
(CHEMBL5204520)Show SMILES Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)-c1nccs1 |(3.88,-2.75,;4.17,-1.55,;5.65,-1.12,;6.01,.38,;4.9,1.44,;5.19,2.64,;3.42,1.01,;2.53,1.86,;3.06,-.49,;1.55,-.81,;.93,-2.21,;1.54,-3.28,;-.61,-2.05,;-1.63,-3.2,;-2.84,-2.94,;-1.25,-4.37,;-.92,-.55,;-2.26,.22,;-2.26,1.76,;-.92,2.53,;.41,1.76,;.41,.22,;-3.59,2.53,;-3.74,4.05,;-5.24,4.37,;-6.01,3.04,;-4.98,1.89,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
MCE
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.30E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.2c00552
BindingDB Entry DOI: 10.7270/Q2028WKQ |
More data for this
Ligand-Target Pair | |
Cytochrome P450 2C9
(Homo sapiens (Human)) | BDBM50598849
(CHEMBL5204520)Show SMILES Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)-c1nccs1 |(3.88,-2.75,;4.17,-1.55,;5.65,-1.12,;6.01,.38,;4.9,1.44,;5.19,2.64,;3.42,1.01,;2.53,1.86,;3.06,-.49,;1.55,-.81,;.93,-2.21,;1.54,-3.28,;-.61,-2.05,;-1.63,-3.2,;-2.84,-2.94,;-1.25,-4.37,;-.92,-.55,;-2.26,.22,;-2.26,1.76,;-.92,2.53,;.41,1.76,;.41,.22,;-3.59,2.53,;-3.74,4.05,;-5.24,4.37,;-6.01,3.04,;-4.98,1.89,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
MCE
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 9.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.2c00552
BindingDB Entry DOI: 10.7270/Q2028WKQ |
More data for this
Ligand-Target Pair | |
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