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Compile Data Set for Download or QSAR
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
(change energy unit to
kcal/mol
)
Found
19
hits in this display
Target
Beta-1 adrenergic receptor
(Rattus norvegicus (Rat))
Niigata College of Pharmacy
Curated by
PDSP K
i
Database
Ligand
BDBM25749
(CHEMBL6995 | N-{4-[2-hydroxy-3-(propan-2-ylamino)p...)
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Affinity Data
Ki: 245nM
More data for this Ligand-Target Pair
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Target
Beta-2 adrenergic receptor
(Homo sapiens (Human))
TBA
Curated by
PDSP K
i
Database
Ligand
BDBM25749
(CHEMBL6995 | N-{4-[2-hydroxy-3-(propan-2-ylamino)p...)
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Affinity Data
Ki: 880nM
More data for this Ligand-Target Pair
Target Info
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Target
Beta-2 adrenergic receptor
(Homo sapiens (Human))
TBA
Curated by
PDSP K
i
Database
Ligand
BDBM25749
(CHEMBL6995 | N-{4-[2-hydroxy-3-(propan-2-ylamino)p...)
Copy SMILES
Copy InChI
Affinity Data
Ki: >1.00E+4nM
More data for this Ligand-Target Pair
Target Info
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Target
5-hydroxytryptamine receptor 1B
(Rattus norvegicus (Rat))
Niigata College of Pharmacy
Curated by
PDSP K
i
Database
Ligand
BDBM25749
(CHEMBL6995 | N-{4-[2-hydroxy-3-(propan-2-ylamino)p...)
Copy SMILES
Copy InChI
Affinity Data
Ki: >1.00E+4nM
More data for this Ligand-Target Pair
Target Info
PDB
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Target
Beta-2 adrenergic receptor
(Rattus norvegicus)
Niigata College of Pharmacy
Curated by
PDSP K
i
Database
Ligand
BDBM25749
(CHEMBL6995 | N-{4-[2-hydroxy-3-(propan-2-ylamino)p...)
Copy SMILES
Copy InChI
Affinity Data
Ki: >1.00E+4nM
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
UniProtKB/SwissProt
B.MOAD
GoogleScholar
Ligand Info
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PubMed
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Target
Beta-2 adrenergic receptor
(Mus musculus)
University of California
Curated by
ChEMBL
Ligand
BDBM25749
(CHEMBL6995 | N-{4-[2-hydroxy-3-(propan-2-ylamino)p...)
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Affinity Data
Ki: 1.35E+4nM
Assay Description:
Ki value was determined by accumulation of c-AMP in S-49 mouse lymphoma cells (Beta2).
More data for this Ligand-Target Pair
Target Info
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Target
Bile salt export pump
(Homo sapiens (Human))
Astrazeneca
Curated by
ChEMBL
Ligand
BDBM25749
(CHEMBL6995 | N-{4-[2-hydroxy-3-(propan-2-ylamino)p...)
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Affinity Data
IC50: >1.00E+6nM
Assay Description:
Inhibition of human BSEP expressed in plasma membrane vesicles of Sf21 cells assessed as inhibition of ATP-dependent [3H]taurocholate uptake
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Target Info
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Target
Bile salt export pump
(Homo sapiens (Human))
Astrazeneca
Curated by
ChEMBL
Ligand
BDBM25749
(CHEMBL6995 | N-{4-[2-hydroxy-3-(propan-2-ylamino)p...)
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Affinity Data
IC50: >1.00E+6nM
Assay Description:
Binding affinity was measured on Cytochrome P450 19A1
More data for this Ligand-Target Pair
Target Info
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Target
Bile salt export pump
(Rattus norvegicus)
Astrazeneca
Curated by
ChEMBL
Ligand
BDBM25749
(CHEMBL6995 | N-{4-[2-hydroxy-3-(propan-2-ylamino)p...)
Copy SMILES
Copy InChI
Affinity Data
IC50: >1.00E+6nM
Assay Description:
Inhibition of Sprague-Dawley rat Bsep expressed in plasma membrane vesicles of Sf21 cells assessed as inhibition of ATP-dependent [3H]taurocholate up...
More data for this Ligand-Target Pair
Target Info
Reactome pathway
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Article
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Target
Beta-2 adrenergic receptor
(BOVINE)
TBA
Curated by
ChEMBL
Ligand
BDBM25749
(CHEMBL6995 | N-{4-[2-hydroxy-3-(propan-2-ylamino)p...)
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Affinity Data
Kd: 1.02E+4nM
Assay Description:
Affinity for cow beta-2 adrenergic receptor by measuring displacement (-)-[3H]dihydroalprenolol (DHA)
More data for this Ligand-Target Pair
Target Info
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Target
Beta-2 adrenergic receptor
(GUINEA PIG)
TBA
Curated by
ChEMBL
Ligand
BDBM25749
(CHEMBL6995 | N-{4-[2-hydroxy-3-(propan-2-ylamino)p...)
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Affinity Data
Kd: 4.47E+3nM
Assay Description:
In vitro beta-2 adrenergic receptor activity was determined by measuring inhibition of the isoproterenol induced relaxation in isolated guinea pig tr...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
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ChEBI
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Copy BDB DOI
Target
Beta-2 adrenergic receptor
(GUINEA PIG)
TBA
Curated by
ChEMBL
Ligand
BDBM25749
(CHEMBL6995 | N-{4-[2-hydroxy-3-(propan-2-ylamino)p...)
Copy SMILES
Copy InChI
Affinity Data
Kd: 1.58E+3nM
Assay Description:
Ability to block Beta-2 adrenergic receptor in guinea pig trachea preparation
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
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Ligand Info
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ChEBI
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Article
PubMed
Copy BDB DOI
Target
Beta-2 adrenergic receptor
(BOVINE)
TBA
Curated by
ChEMBL
Ligand
BDBM25749
(CHEMBL6995 | N-{4-[2-hydroxy-3-(propan-2-ylamino)p...)
Copy SMILES
Copy InChI
Affinity Data
Kd: 2.04E+4nM
Assay Description:
Affinity for cow beta-2 adrenergic receptor by measuring displacement (-)-[3H]dihydroalprenolol (DHA)
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
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Ligand Info
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ChEBI
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In Depth
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Article
PubMed
Copy BDB DOI
Target
Beta-1 adrenergic receptor
(GUINEA PIG)
TBA
Curated by
ChEMBL
Ligand
BDBM25749
(CHEMBL6995 | N-{4-[2-hydroxy-3-(propan-2-ylamino)p...)
Copy SMILES
Copy InChI
Affinity Data
Kd: 105nM
Assay Description:
In vitro beta-1 adrenergic receptor activity was determined via inhibition of the positive chronotropic actions of isoproterenol in isolated guinea p...
More data for this Ligand-Target Pair
Target Info
PDB
UniProtKB/TrEMBL
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ChEBI
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In Depth
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Article
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Copy BDB DOI
Target
Beta-1 adrenergic receptor
(GUINEA PIG)
TBA
Curated by
ChEMBL
Ligand
BDBM25749
(CHEMBL6995 | N-{4-[2-hydroxy-3-(propan-2-ylamino)p...)
Copy SMILES
Copy InChI
Affinity Data
Kd: 251nM
Assay Description:
Ability to block Beta-1 adrenergic receptor in guinea pig right atria preparation
More data for this Ligand-Target Pair
Target Info
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ChEBI
CHEMBL
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PC sid
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In Depth
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Article
PubMed
Copy BDB DOI
Target
Beta-1 adrenergic receptor
(GUINEA PIG)
TBA
Curated by
ChEMBL
Ligand
BDBM25749
(CHEMBL6995 | N-{4-[2-hydroxy-3-(propan-2-ylamino)p...)
Copy SMILES
Copy InChI
Affinity Data
Kd: 174nM
Assay Description:
Antagonist activity of compound against Beta-1 adrenergic receptor in isolated guinea pig left atria
More data for this Ligand-Target Pair
Target Info
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Target
Beta-3 adrenergic receptor
(Homo sapiens (Human))
University of Nottingham
Ligand
BDBM25749
(CHEMBL6995 | N-{4-[2-hydroxy-3-(propan-2-ylamino)p...)
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Affinity Data
Kd: >1.00E+5nM
Assay Description:
The whole cell-binding studies were undertaken in CHO cell lines stably expressing each beta-adrenoceptor subtype. Nonspecific binding was determined...
More data for this Ligand-Target Pair
Target Info
PDB
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KEGG
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ChEBI
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In Depth
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Copy BDB DOI
Target
Beta-1 adrenergic receptor
(Homo sapiens (Human))
University of Nottingham
Ligand
BDBM25749
(CHEMBL6995 | N-{4-[2-hydroxy-3-(propan-2-ylamino)p...)
Copy SMILES
Copy InChI
Affinity Data
Kd: 724nM
pH: 7.4 T: 2°C
Assay Description:
The whole cell-binding studies were undertaken in CHO cell lines stably expressing each beta-adrenoceptor subtype. Nonspecific binding was determined...
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
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antibodypedia
GoogleScholar
Ligand Info
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ChEBI
CHEMBL
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PC sid
Patents
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In Depth
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Article
PubMed
DrugBank
Copy BDB DOI
Target
Beta-2 adrenergic receptor
(Homo sapiens (Human))
TBA
Curated by
PDSP K
i
Database
Ligand
BDBM25749
(CHEMBL6995 | N-{4-[2-hydroxy-3-(propan-2-ylamino)p...)
Copy SMILES
Copy InChI
Affinity Data
Kd: 1.02E+4nM
Assay Description:
The whole cell-binding studies were undertaken in CHO cell lines stably expressing each beta-adrenoceptor subtype. Nonspecific binding was determined...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
ChEBI
CHEMBL
DrugBank
PC cid
PC sid
Patents
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In Depth
Details
Article
PubMed
Copy BDB DOI