Found 4 hits for monomerid = 50598848 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)) | BDBM50598848
(CHEMBL5182071)Show SMILES Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)-c1ncc(F)cc1F |(4.54,-2.98,;4.83,-1.78,;6.31,-1.35,;6.67,.15,;5.56,1.21,;5.85,2.41,;4.08,.78,;3.19,1.63,;3.72,-.72,;2.21,-1.04,;1.59,-2.45,;2.2,-3.52,;.05,-2.29,;-.97,-3.43,;-2.18,-3.18,;-.59,-4.61,;-.27,-.78,;-1.6,-.01,;-1.6,1.53,;-.27,2.3,;1.07,1.53,;1.07,-.01,;-2.94,2.3,;-4.27,1.53,;-5.6,2.29,;-5.6,3.83,;-6.67,4.45,;-4.27,4.61,;-2.94,3.84,;-1.87,4.46,)| | PDB
UniProtKB/SwissProt
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 |
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)) | BDBM50598848
(CHEMBL5182071)Show SMILES Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)-c1ncc(F)cc1F |(4.54,-2.98,;4.83,-1.78,;6.31,-1.35,;6.67,.15,;5.56,1.21,;5.85,2.41,;4.08,.78,;3.19,1.63,;3.72,-.72,;2.21,-1.04,;1.59,-2.45,;2.2,-3.52,;.05,-2.29,;-.97,-3.43,;-2.18,-3.18,;-.59,-4.61,;-.27,-.78,;-1.6,-.01,;-1.6,1.53,;-.27,2.3,;1.07,1.53,;1.07,-.01,;-2.94,2.3,;-4.27,1.53,;-5.6,2.29,;-5.6,3.83,;-6.67,4.45,;-4.27,4.61,;-2.94,3.84,;-1.87,4.46,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 50 | 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)) | BDBM50598848
(CHEMBL5182071)Show SMILES Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)-c1ncc(F)cc1F |(4.54,-2.98,;4.83,-1.78,;6.31,-1.35,;6.67,.15,;5.56,1.21,;5.85,2.41,;4.08,.78,;3.19,1.63,;3.72,-.72,;2.21,-1.04,;1.59,-2.45,;2.2,-3.52,;.05,-2.29,;-.97,-3.43,;-2.18,-3.18,;-.59,-4.61,;-.27,-.78,;-1.6,-.01,;-1.6,1.53,;-.27,2.3,;1.07,1.53,;1.07,-.01,;-2.94,2.3,;-4.27,1.53,;-5.6,2.29,;-5.6,3.83,;-6.67,4.45,;-4.27,4.61,;-2.94,3.84,;-1.87,4.46,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
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 |
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)) | BDBM50598848
(CHEMBL5182071)Show SMILES Cc1ccc(O)c(C)c1-n1c(N)c(C(N)=O)c2nc(cnc12)-c1ncc(F)cc1F |(4.54,-2.98,;4.83,-1.78,;6.31,-1.35,;6.67,.15,;5.56,1.21,;5.85,2.41,;4.08,.78,;3.19,1.63,;3.72,-.72,;2.21,-1.04,;1.59,-2.45,;2.2,-3.52,;.05,-2.29,;-.97,-3.43,;-2.18,-3.18,;-.59,-4.61,;-.27,-.78,;-1.6,-.01,;-1.6,1.53,;-.27,2.3,;1.07,1.53,;1.07,-.01,;-2.94,2.3,;-4.27,1.53,;-5.6,2.29,;-5.6,3.83,;-6.67,4.45,;-4.27,4.61,;-2.94,3.84,;-1.87,4.46,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 8.00E+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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