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Compile Data Set for Download or QSAR
maximum 50k data
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
(change energy unit to
kcal/mol
)
Found
33
hits in this display
Target
Beta-2 adrenergic receptor
(Homo sapiens (Human))
Heptares Therapeutics
Curated by
ChEMBL
Ligand
BDBM50347779
(CHEMBL1233771)
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Affinity Data
Ki: 9nM
Assay Description:
Displacement of radioligand from human adrenergic beta2 receptor
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
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Target
Glycylpeptide N-tetradecanoyltransferase
(Candida albicans (Yeast))
Nippon Roche Research Center
Ligand
BDBM96235
(4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-c...)
Copy SMILES
Copy InChI
Affinity Data
Ki: 50nM
Assay Description:
Inhibition activity against C. albicans Nmt and human Nmt as assessed by IC50 using myristoyl-CoA (0.5 uM) and peptide substrate GLTISKLFRR-NH2 (0.5 ...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
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Target
Glycylpeptide N-tetradecanoyltransferase
(Candida albicans (Yeast))
Nippon Roche Research Center
Ligand
BDBM96235
(4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-c...)
Copy SMILES
Copy InChI
Affinity Data
Ki: 140nM
Assay Description:
Inhibition activity against C. albicans Nmt and human Nmt as assessed by IC50 using myristoyl-CoA (0.5 uM) and peptide substrate GLTISKLFRR-NH2 (0.5 ...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
Ligand Info
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Target
Glycylpeptide N-tetradecanoyltransferase
(Candida albicans (Yeast))
Nippon Roche Research Center
Ligand
BDBM96235
(4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-c...)
Copy SMILES
Copy InChI
Affinity Data
Ki: 240nM
Assay Description:
Inhibition activity against C. albicans Nmt and human Nmt as assessed by IC50 using myristoyl-CoA (0.5 uM) and peptide substrate GLTISKLFRR-NH2 (0.5 ...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
Ligand Info
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Target
Glycylpeptide N-tetradecanoyltransferase
(Candida albicans (Yeast))
Nippon Roche Research Center
Ligand
BDBM96235
(4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-c...)
Copy SMILES
Copy InChI
Affinity Data
Ki: 260nM
Assay Description:
Inhibition activity against C. albicans Nmt and human Nmt as assessed by IC50 using myristoyl-CoA (0.5 uM) and peptide substrate GLTISKLFRR-NH2 (0.5 ...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
Ligand Info
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CHEMBL
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Target
Glycylpeptide N-tetradecanoyltransferase
(Candida albicans (Yeast))
Nippon Roche Research Center
Ligand
BDBM96235
(4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-c...)
Copy SMILES
Copy InChI
Affinity Data
Ki: 280nM
Assay Description:
Inhibition activity against C. albicans Nmt and human Nmt as assessed by IC50 using myristoyl-CoA (0.5 uM) and peptide substrate GLTISKLFRR-NH2 (0.5 ...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
Ligand Info
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Target
Glycylpeptide N-tetradecanoyltransferase
(Candida albicans (Yeast))
Nippon Roche Research Center
Ligand
BDBM96235
(4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-c...)
Copy SMILES
Copy InChI
Affinity Data
Ki: 360nM
Assay Description:
Inhibition activity against C. albicans Nmt and human Nmt as assessed by IC50 using myristoyl-CoA (0.5 uM) and peptide substrate GLTISKLFRR-NH2 (0.5 ...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
Ligand Info
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Target
Glycylpeptide N-tetradecanoyltransferase
(Candida albicans (Yeast))
Nippon Roche Research Center
Ligand
BDBM96235
(4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-c...)
Copy SMILES
Copy InChI
Affinity Data
Ki: 390nM
Assay Description:
Inhibition activity against C. albicans Nmt and human Nmt as assessed by IC50 using myristoyl-CoA (0.5 uM) and peptide substrate GLTISKLFRR-NH2 (0.5 ...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
Ligand Info
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CHEMBL
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PC sid
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In Depth
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Target
Glycylpeptide N-tetradecanoyltransferase
(Candida albicans (Yeast))
Nippon Roche Research Center
Ligand
BDBM96235
(4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-c...)
Copy SMILES
Copy InChI
Affinity Data
Ki: 420nM
Assay Description:
Inhibition activity against C. albicans Nmt and human Nmt as assessed by IC50 using myristoyl-CoA (0.5 uM) and peptide substrate GLTISKLFRR-NH2 (0.5 ...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
Ligand Info
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CHEMBL
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Target
Glycylpeptide N-tetradecanoyltransferase
(Candida albicans (Yeast))
Nippon Roche Research Center
Ligand
BDBM96235
(4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-c...)
Copy SMILES
Copy InChI
Affinity Data
Ki: 450nM
Assay Description:
Inhibition activity against C. albicans Nmt and human Nmt as assessed by IC50 using myristoyl-CoA (0.5 uM) and peptide substrate GLTISKLFRR-NH2 (0.5 ...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
Ligand Info
Purchase
CHEMBL
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PC sid
PDB
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In Depth
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Article
PubMed
Copy BDB DOI
Target
Glycylpeptide N-tetradecanoyltransferase
(Candida albicans (Yeast))
Nippon Roche Research Center
Ligand
BDBM96235
(4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-c...)
Copy SMILES
Copy InChI
Affinity Data
Ki: 450nM
Assay Description:
Inhibition activity against C. albicans Nmt and human Nmt as assessed by IC50 using myristoyl-CoA (0.5 uM) and peptide substrate GLTISKLFRR-NH2 (0.5 ...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
Ligand Info
Purchase
CHEMBL
PC cid
PC sid
PDB
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Glycylpeptide N-tetradecanoyltransferase
(Candida albicans (Yeast))
Nippon Roche Research Center
Ligand
BDBM96235
(4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-c...)
Copy SMILES
Copy InChI
Affinity Data
Ki: 450nM
Assay Description:
Inhibition activity against C. albicans Nmt and human Nmt as assessed by IC50 using myristoyl-CoA (0.5 uM) and peptide substrate GLTISKLFRR-NH2 (0.5 ...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
Ligand Info
Purchase
CHEMBL
PC cid
PC sid
PDB
Similars
In Depth
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Article
PubMed
Copy BDB DOI
Target
Glycylpeptide N-tetradecanoyltransferase
(Candida albicans (Yeast))
Nippon Roche Research Center
Ligand
BDBM96235
(4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-c...)
Copy SMILES
Copy InChI
Affinity Data
Ki: 540nM
Assay Description:
Inhibition activity against C. albicans Nmt and human Nmt as assessed by IC50 using myristoyl-CoA (0.5 uM) and peptide substrate GLTISKLFRR-NH2 (0.5 ...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
Ligand Info
Purchase
CHEMBL
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PC sid
PDB
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In Depth
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Article
PubMed
Copy BDB DOI
Target
Glycylpeptide N-tetradecanoyltransferase
(Candida albicans (Yeast))
Nippon Roche Research Center
Ligand
BDBM96235
(4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-c...)
Copy SMILES
Copy InChI
Affinity Data
Ki: 540nM
Assay Description:
Inhibition activity against C. albicans Nmt and human Nmt as assessed by IC50 using myristoyl-CoA (0.5 uM) and peptide substrate GLTISKLFRR-NH2 (0.5 ...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
Ligand Info
Purchase
CHEMBL
PC cid
PC sid
PDB
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In Depth
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Article
PubMed
Copy BDB DOI
Target
Glycylpeptide N-tetradecanoyltransferase
(Candida albicans (Yeast))
Nippon Roche Research Center
Ligand
BDBM96235
(4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-c...)
Copy SMILES
Copy InChI
Affinity Data
Ki: 600nM IC50: 980nM
Assay Description:
Inhibition activity against C. albicans Nmt and human Nmt as assessed by IC50 using myristoyl-CoA (0.5 uM) and peptide substrate GLTISKLFRR-NH2 (0.5 ...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
Ligand Info
Purchase
CHEMBL
PC cid
PC sid
PDB
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Glycylpeptide N-tetradecanoyltransferase
(Candida albicans (Yeast))
Nippon Roche Research Center
Ligand
BDBM96235
(4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-c...)
Copy SMILES
Copy InChI
Affinity Data
Ki: 690nM
Assay Description:
Inhibition activity against C. albicans Nmt and human Nmt as assessed by IC50 using myristoyl-CoA (0.5 uM) and peptide substrate GLTISKLFRR-NH2 (0.5 ...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
Ligand Info
Purchase
CHEMBL
PC cid
PC sid
PDB
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Glycylpeptide N-tetradecanoyltransferase
(Candida albicans (Yeast))
Nippon Roche Research Center
Ligand
BDBM96235
(4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-c...)
Copy SMILES
Copy InChI
Affinity Data
Ki: 860nM
Assay Description:
Inhibition activity against C. albicans Nmt and human Nmt as assessed by IC50 using myristoyl-CoA (0.5 uM) and peptide substrate GLTISKLFRR-NH2 (0.5 ...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
Ligand Info
Purchase
CHEMBL
PC cid
PC sid
PDB
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Glycylpeptide N-tetradecanoyltransferase
(Candida albicans (Yeast))
Nippon Roche Research Center
Ligand
BDBM96235
(4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-c...)
Copy SMILES
Copy InChI
Affinity Data
Ki: 890nM
Assay Description:
Inhibition activity against C. albicans Nmt and human Nmt as assessed by IC50 using myristoyl-CoA (0.5 uM) and peptide substrate GLTISKLFRR-NH2 (0.5 ...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
Ligand Info
Purchase
CHEMBL
PC cid
PC sid
PDB
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In Depth
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Article
PubMed
Copy BDB DOI
Target
Glycylpeptide N-tetradecanoyltransferase
(Candida albicans (Yeast))
Nippon Roche Research Center
Ligand
BDBM96235
(4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-c...)
Copy SMILES
Copy InChI
Affinity Data
Ki: 1.00E+3nM
Assay Description:
Inhibition activity against C. albicans Nmt and human Nmt as assessed by IC50 using myristoyl-CoA (0.5 uM) and peptide substrate GLTISKLFRR-NH2 (0.5 ...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
Ligand Info
Purchase
CHEMBL
PC cid
PC sid
PDB
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In Depth
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Article
PubMed
Copy BDB DOI
Target
Glycylpeptide N-tetradecanoyltransferase
(Candida albicans (Yeast))
Nippon Roche Research Center
Ligand
BDBM96235
(4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-c...)
Copy SMILES
Copy InChI
Affinity Data
Ki: 1.10E+3nM
Assay Description:
Inhibition activity against C. albicans Nmt and human Nmt as assessed by IC50 using myristoyl-CoA (0.5 uM) and peptide substrate GLTISKLFRR-NH2 (0.5 ...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
Ligand Info
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CHEMBL
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PC sid
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Article
PubMed
Copy BDB DOI
Target
Glycylpeptide N-tetradecanoyltransferase
(Candida albicans (Yeast))
Nippon Roche Research Center
Ligand
BDBM96235
(4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-c...)
Copy SMILES
Copy InChI
Affinity Data
Ki: 1.70E+3nM
Assay Description:
Inhibition activity against C. albicans Nmt and human Nmt as assessed by IC50 using myristoyl-CoA (0.5 uM) and peptide substrate GLTISKLFRR-NH2 (0.5 ...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
Ligand Info
Purchase
CHEMBL
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PC sid
PDB
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In Depth
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Article
PubMed
Copy BDB DOI
Target
Glycylpeptide N-tetradecanoyltransferase
(Candida albicans (Yeast))
Nippon Roche Research Center
Ligand
BDBM96235
(4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-c...)
Copy SMILES
Copy InChI
Affinity Data
Ki: 1.90E+3nM
Assay Description:
Inhibition activity against C. albicans Nmt and human Nmt as assessed by IC50 using myristoyl-CoA (0.5 uM) and peptide substrate GLTISKLFRR-NH2 (0.5 ...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
Ligand Info
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CHEMBL
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PC sid
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In Depth
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PubMed
Copy BDB DOI
Target
Glycylpeptide N-tetradecanoyltransferase
(Candida albicans (Yeast))
Nippon Roche Research Center
Ligand
BDBM96235
(4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-c...)
Copy SMILES
Copy InChI
Affinity Data
Ki: 2.20E+3nM
Assay Description:
Inhibition activity against C. albicans Nmt and human Nmt as assessed by IC50 using myristoyl-CoA (0.5 uM) and peptide substrate GLTISKLFRR-NH2 (0.5 ...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
Ligand Info
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CHEMBL
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PC sid
PDB
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In Depth
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Article
PubMed
Copy BDB DOI
Target
Glycylpeptide N-tetradecanoyltransferase
(Candida albicans (Yeast))
Nippon Roche Research Center
Ligand
BDBM96235
(4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-c...)
Copy SMILES
Copy InChI
Affinity Data
Ki: 2.60E+3nM
Assay Description:
Inhibition activity against C. albicans Nmt and human Nmt as assessed by IC50 using myristoyl-CoA (0.5 uM) and peptide substrate GLTISKLFRR-NH2 (0.5 ...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
Ligand Info
Purchase
CHEMBL
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PC sid
PDB
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In Depth
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Article
PubMed
Copy BDB DOI
Target
Glycylpeptide N-tetradecanoyltransferase
(Candida albicans (Yeast))
Nippon Roche Research Center
Ligand
BDBM96235
(4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-c...)
Copy SMILES
Copy InChI
Affinity Data
Ki: 6.90E+3nM
Assay Description:
Inhibition activity against C. albicans Nmt and human Nmt as assessed by IC50 using myristoyl-CoA (0.5 uM) and peptide substrate GLTISKLFRR-NH2 (0.5 ...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
Ligand Info
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CHEMBL
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In Depth
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Article
PubMed
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Target
Glycylpeptide N-tetradecanoyltransferase
(Candida albicans (Yeast))
Nippon Roche Research Center
Ligand
BDBM96235
(4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-c...)
Copy SMILES
Copy InChI
Affinity Data
Ki: >8.90E+4nM
Assay Description:
Inhibition activity against C. albicans Nmt and human Nmt as assessed by IC50 using myristoyl-CoA (0.5 uM) and peptide substrate GLTISKLFRR-NH2 (0.5 ...
More data for this Ligand-Target Pair
Target Info
PDB
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Target
Beta-1/Beta-2/Beta-3 adrenergic receptor
(Homo sapiens (Human))
Nippon Roche Research Center
Curated by
ChEMBL
Ligand
BDBM96235
(4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-c...)
Copy SMILES
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Affinity Data
IC50: 98nM
Assay Description:
Compound was evaluated for its Beta adrenergic receptor blocking action
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
antibodypedia
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Target
Fructose-bisphosphate aldolase
(Mycobacterium tuberculosis (strain H37Rv))
The Scripps Research Institute Molecular Screening Center
Curated by
PubChem BioAssay
Ligand
BDBM96235
(4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-c...)
Copy SMILES
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Affinity Data
IC50: 843nM
More data for this Ligand-Target Pair
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Target
Glycylpeptide N-tetradecanoyltransferase 1/2
(Homo sapiens (Human))
Nippon Roche Research Center
Curated by
ChEMBL
Ligand
BDBM96235
(4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-c...)
Copy SMILES
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Affinity Data
IC50: 980nM
Assay Description:
Inhibitory activity against Candida albicans N-myristoyltransferase (CaNmt)
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
UniProtKB/SwissProt
antibodypedia
antibodypedia
GoogleScholar
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Target
Glycylpeptide N-tetradecanoyltransferase 1/2
(Homo sapiens (Human))
Nippon Roche Research Center
Curated by
ChEMBL
Ligand
BDBM96235
(4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-c...)
Copy SMILES
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Affinity Data
IC50: 1.94E+5nM
Assay Description:
In vitro ability of the compound to displace radiolabelled FTI from farnesyltransferase in cultured Ha-ras transformed RAT1 cells
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
UniProtKB/SwissProt
antibodypedia
antibodypedia
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Target
Glycylpeptide N-tetradecanoyltransferase 1
(Homo sapiens (Human))
Nippon Roche Research Center
Ligand
BDBM96235
(4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-c...)
Copy SMILES
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Affinity Data
IC50: 1.94E+5nM
Assay Description:
Inhibition activity against C. albicans Nmt and human Nmt as assessed by IC50 using myristoyl-CoA (0.5 uM) and peptide substrate GLTISKLFRR-NH2 (0.5 ...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
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CHEMBL
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Target
Glycylpeptide N-tetradecanoyltransferase
(Candida albicans (Yeast))
Nippon Roche Research Center
Ligand
BDBM96235
(4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-c...)
Copy SMILES
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Affinity Data
IC50: 2.27E+8nM
Assay Description:
Inhibition of candida N-myristoyltransferase
More data for this Ligand-Target Pair
Target Info
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MMDB
KEGG
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B.MOAD
DrugBank
GoogleScholar
Ligand Info
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Target
Glycylpeptide N-tetradecanoyltransferase
(Candida albicans (Yeast))
Nippon Roche Research Center
Ligand
BDBM96235
(4-[2-hydroxy-3-(isopropylamino)propoxy]-3-methyl-c...)
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Affinity Data
IC50: 2.27E+8nM
Assay Description:
Inhibition of candida N-myristoyltransferase
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Target Info
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KEGG
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Ligand Info
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