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Compile Data Set for Download or QSAR
Found
57
Enz. Inhib. hit(s) with all data for entry = 50017873
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM601033
(1-[2,4-dichloro-3-(trifluoromethyl)phenyl]triazole...)
copy SMILES
Affinity Data
IC50: 4.60nM
More data for this Ligand-Target Pair
Target Info
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MCE
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PC sid
PDB
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
PDB
3D Structure (crystal)
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM601033
(1-[2,4-dichloro-3-(trifluoromethyl)phenyl]triazole...)
copy SMILES
Affinity Data
IC50: 6.30nM
More data for this Ligand-Target Pair
Target Info
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MCE
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PC sid
PDB
In Depth
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Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
PDB
3D Structure (crystal)
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM601044
(3,5-dichloro-2-(triazol-1-yl)-4-(trifluoromethyl)p...)
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Affinity Data
IC50: 7.5nM
More data for this Ligand-Target Pair
Target Info
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PC sid
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM601015
(US11634391, Compound 277 | [1-[2,4-dichloro-3-(tri...)
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Affinity Data
IC50: 9.5nM
More data for this Ligand-Target Pair
Target Info
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Ligand Info
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PC sid
PDB
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
PDB
3D Structure (crystal)
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM601028
(1-(2,3,4-trichlorophenyl)triazole | US11634391, Co...)
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Affinity Data
IC50: 18nM
More data for this Ligand-Target Pair
Target Info
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In Depth
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Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM50605708
(CHEMBL5179683)
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Affinity Data
IC50: 31nM
More data for this Ligand-Target Pair
Target Info
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Ligand Info
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PC sid
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM600801
((1-(4-chloro-3-(trifluoromethyl)phenyl)-1H-1,2,3-t...)
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Affinity Data
IC50: 65nM
More data for this Ligand-Target Pair
Target Info
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UniProtKB/SwissProt
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Ligand Info
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PC sid
PDB
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
PDB
3D Structure (crystal)
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM50605713
(CHEMBL5194024)
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Affinity Data
IC50: 110nM
More data for this Ligand-Target Pair
Target Info
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In Depth
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Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM601035
(1-(2,4-dichloro-3-(trifluoromethyl)phenyl)-1H-tetr...)
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Affinity Data
IC50: 140nM
More data for this Ligand-Target Pair
Target Info
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Ligand Info
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PC sid
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM601033
(1-[2,4-dichloro-3-(trifluoromethyl)phenyl]triazole...)
copy SMILES
Affinity Data
IC50: 170nM
More data for this Ligand-Target Pair
Target Info
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PC sid
PDB
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
PDB
3D Structure (crystal)
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM50605712
(CHEMBL5172218)
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Affinity Data
IC50: 200nM
More data for this Ligand-Target Pair
Target Info
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In Depth
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Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM600807
((1-(3,4-dichlorophenyl)-1H-1,2,3-triazol-4-yl)meth...)
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Affinity Data
IC50: 500nM
More data for this Ligand-Target Pair
Target Info
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PC cid
PC sid
PDB
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
PDB
3D Structure (crystal)
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM600778
((1-(3,4-dimethylphenyl)-1H-1,2,3-triazol-4-yl)meth...)
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Affinity Data
IC50: 730nM
More data for this Ligand-Target Pair
Target Info
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Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM50605711
(CHEMBL5187745)
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Affinity Data
IC50: 910nM
More data for this Ligand-Target Pair
Target Info
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Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Cytochrome P450 1A2
(Homo sapiens (Human))
TBA
Ligand
BDBM601033
(1-[2,4-dichloro-3-(trifluoromethyl)phenyl]triazole...)
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Affinity Data
IC50: 960nM
More data for this Ligand-Target Pair
Target Info
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Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM600803
((1-(3-chloro-4-(trifluoromethyl)phenyl)-1H-1,2,3-t...)
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Affinity Data
IC50: 1.00E+3nM
More data for this Ligand-Target Pair
Target Info
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PC sid
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM50605709
(CHEMBL5189276)
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Affinity Data
IC50: 1.20E+3nM
More data for this Ligand-Target Pair
Target Info
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PC sid
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM601037
(4-(2,4-dichloro-3-(trifluoromethyl)phenyl)-4H-1,2,...)
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Affinity Data
IC50: 1.30E+3nM
More data for this Ligand-Target Pair
Target Info
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Ligand Info
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PC sid
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM50605706
(CHEMBL5170555)
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Affinity Data
IC50: 1.70E+3nM
More data for this Ligand-Target Pair
Target Info
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In Depth
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Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM50605705
(CHEMBL5188040)
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Affinity Data
IC50: 1.80E+3nM
More data for this Ligand-Target Pair
Target Info
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PC sid
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM601047
(1-[1-[2,4-dichloro-3-(trifluoromethyl)phenyl]triaz...)
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Affinity Data
IC50: 1.80E+3nM
More data for this Ligand-Target Pair
Target Info
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PC sid
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM50605703
(CHEMBL5198105)
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Affinity Data
IC50: 2.20E+3nM
More data for this Ligand-Target Pair
Target Info
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PC sid
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM601013
((1-(3-(trifluoromethyl)phenyl)-1H-1,2,3-triazol-4-...)
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Affinity Data
IC50: 2.30E+3nM
More data for this Ligand-Target Pair
Target Info
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Ligand Info
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PC sid
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM50605710
(CHEMBL5201676)
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Affinity Data
IC50: 2.30E+3nM
More data for this Ligand-Target Pair
Target Info
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PC sid
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM600812
((1-(3,5-dichlorophenyl)-1H-1,2,3-triazol-4-yl)meth...)
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Affinity Data
IC50: 2.40E+3nM
More data for this Ligand-Target Pair
Target Info
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PC sid
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
5-hydroxytryptamine receptor 3A
(Homo sapiens (Human))
TBA
Ligand
BDBM601033
(1-[2,4-dichloro-3-(trifluoromethyl)phenyl]triazole...)
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Affinity Data
IC50: 4.50E+3nM
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
KEGG
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antibodypedia
GoogleScholar
Ligand Info
Purchase
MCE
PC cid
PC sid
PDB
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM600799
((1-(2,3-dichlorophenyl)-1H-1,2,3-triazol-4-yl)meth...)
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Affinity Data
IC50: 5.10E+3nM
More data for this Ligand-Target Pair
Target Info
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Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Cytochrome P450 2B6
(Homo sapiens (Human))
TBA
Ligand
BDBM601033
(1-[2,4-dichloro-3-(trifluoromethyl)phenyl]triazole...)
copy SMILES
Affinity Data
IC50: 5.20E+3nM
More data for this Ligand-Target Pair
Target Info
PDB
KEGG
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B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
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MCE
PC cid
PC sid
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In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM600800
((1-(2,4-dichlorophenyl)-1H-1,2,3-triazol-4-yl)meth...)
copy SMILES
Affinity Data
IC50: 5.60E+3nM
More data for this Ligand-Target Pair
Target Info
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UniProtKB/SwissProt
GoogleScholar
Ligand Info
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PC sid
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM50605704
(CHEMBL5197210)
copy SMILES
Affinity Data
IC50: 5.70E+3nM
More data for this Ligand-Target Pair
Target Info
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UniProtKB/SwissProt
GoogleScholar
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PC sid
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM600809
((1-(3-chlorophenyl)-1H-1,2,3-triazol-4-yl)methanol...)
copy SMILES
Affinity Data
IC50: 6.30E+3nM
More data for this Ligand-Target Pair
Target Info
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GoogleScholar
Ligand Info
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PC sid
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM50605707
(CHEMBL5197254)
copy SMILES
Affinity Data
IC50: 7.40E+3nM
More data for this Ligand-Target Pair
Target Info
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PC sid
In Depth
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Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Cytochrome P450 2C19
(Homo sapiens (Human))
TBA
Ligand
BDBM601033
(1-[2,4-dichloro-3-(trifluoromethyl)phenyl]triazole...)
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Affinity Data
IC50: 8.10E+3nM
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
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B.MOAD
DrugBank
antibodypedia
GoogleScholar
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In Depth
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Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM601011
((1-(4-(trifluoromethyl)phenyl)-1H-1,2,3-triazol-4-...)
copy SMILES
Affinity Data
IC50: 8.80E+3nM
More data for this Ligand-Target Pair
Target Info
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PC sid
In Depth
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Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Neuronal acetylcholine receptor subunit alpha-4/beta-2
(Homo sapiens (Human))
TBA
Ligand
BDBM601033
(1-[2,4-dichloro-3-(trifluoromethyl)phenyl]triazole...)
copy SMILES
Affinity Data
IC50: 1.00E+4nM
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
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MCE
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In Depth
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Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM50554503
(CHEMBL1482091 | US11634391, Compound 29)
copy SMILES
Affinity Data
IC50: 1.20E+4nM
More data for this Ligand-Target Pair
Target Info
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UniProtKB/SwissProt
GoogleScholar
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MCE
PC cid
PC sid
PDB
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
PDB
3D Structure (crystal)
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM50605700
(CHEMBL1823283)
copy SMILES
Affinity Data
IC50: 1.30E+4nM
More data for this Ligand-Target Pair
Target Info
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PC sid
In Depth
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Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Cytochrome P450 2C9
(Homo sapiens (Human))
TBA
Ligand
BDBM601033
(1-[2,4-dichloro-3-(trifluoromethyl)phenyl]triazole...)
copy SMILES
Affinity Data
IC50: 1.50E+4nM
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
MCE
PC cid
PC sid
PDB
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM600811
((1-(2,5-dichlorophenyl)-1H-1,2,3-triazol-4-yl)meth...)
copy SMILES
Affinity Data
IC50: 2.30E+4nM
More data for this Ligand-Target Pair
Target Info
PDB
UniProtKB/SwissProt
GoogleScholar
Ligand Info
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PC sid
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM50605697
(CHEMBL5178498)
copy SMILES
Affinity Data
IC50: 2.50E+4nM
More data for this Ligand-Target Pair
Target Info
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PC sid
In Depth
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Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Amine oxidase [flavin-containing] A
(Homo sapiens (Human))
TBA
Ligand
BDBM601033
(1-[2,4-dichloro-3-(trifluoromethyl)phenyl]triazole...)
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Affinity Data
IC50: 2.80E+4nM
More data for this Ligand-Target Pair
Target Info
PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
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Purchase
MCE
PC cid
PC sid
PDB
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM600777
((1-(benzo[d][1,3]dioxol-5-yl)-1H-1,2,3-triazol-4-y...)
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Affinity Data
IC50: 2.80E+4nM
More data for this Ligand-Target Pair
Target Info
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PC sid
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Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Sodium channel protein type 5 subunit alpha
(Homo sapiens (Human))
TBA
Ligand
BDBM601033
(1-[2,4-dichloro-3-(trifluoromethyl)phenyl]triazole...)
copy SMILES
Affinity Data
IC50: 3.00E+4nM
More data for this Ligand-Target Pair
Target Info
PDB
KEGG
UniProtKB/SwissProt
B.MOAD
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antibodypedia
GoogleScholar
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MCE
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Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human))
TBA
Ligand
BDBM601033
(1-[2,4-dichloro-3-(trifluoromethyl)phenyl]triazole...)
copy SMILES
Affinity Data
IC50: 3.00E+4nM
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
MCE
PC cid
PC sid
PDB
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM600798
((1-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-1H-1,2,3-...)
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Affinity Data
IC50: 3.20E+4nM
More data for this Ligand-Target Pair
Target Info
PDB
UniProtKB/SwissProt
GoogleScholar
Ligand Info
PC cid
PC sid
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Palmitoleoyl-protein carboxylesterase NOTUM
(Homo sapiens (Human))
TBA
Ligand
BDBM600808
((1-(2-chlorophenyl)-1H-1,2,3-triazol-4-yl)methanol...)
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Affinity Data
IC50: 3.20E+4nM
More data for this Ligand-Target Pair
Target Info
PDB
UniProtKB/SwissProt
GoogleScholar
Ligand Info
PC cid
PC sid
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Cytochrome P450 3A4
(Homo sapiens (Human))
TBA
Ligand
BDBM601033
(1-[2,4-dichloro-3-(trifluoromethyl)phenyl]triazole...)
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Affinity Data
IC50: 5.00E+4nM
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
MCE
PC cid
PC sid
PDB
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Cytochrome P450 3A4
(Homo sapiens (Human))
TBA
Ligand
BDBM601033
(1-[2,4-dichloro-3-(trifluoromethyl)phenyl]triazole...)
copy SMILES
Affinity Data
IC50: 5.00E+4nM
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
MCE
PC cid
PC sid
PDB
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Cytochrome P450 2D6
(Homo sapiens (Human))
TBA
Ligand
BDBM601033
(1-[2,4-dichloro-3-(trifluoromethyl)phenyl]triazole...)
copy SMILES
Affinity Data
IC50: 5.00E+4nM
More data for this Ligand-Target Pair
Target Info
PDB
UniProtKB/SwissProt
GoogleScholar
Ligand Info
Purchase
MCE
PC cid
PC sid
PDB
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
Target
Cytochrome P450 2C8
(Homo sapiens (Human))
TBA
Ligand
BDBM601033
(1-[2,4-dichloro-3-(trifluoromethyl)phenyl]triazole...)
copy SMILES
Affinity Data
IC50: 5.00E+4nM
More data for this Ligand-Target Pair
Target Info
PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
MCE
PC cid
PC sid
PDB
In Depth
Details
Article
BindingDB Entry DOI:
10.7270/Q2KH0SDZ
PubMed
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