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Target
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Compile Data Set for Download or QSAR
Found
5
hits Enz. Inhib. hit(s) with Target = 'Cyclin-dependent kinase 9' and Ligand = 'BDBM50570974'
Target/Host
(Institution)
Ligand
Target/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
k
off
s
-1
k
on
M
-1
s
-1
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°C
Cyclin-dependent kinase 9
(Homo sapiens (Human))
BDBM50570974
(CHEMBL4846069)
Show SMILES
COc1ccc(CC(=O)Nc2cc([nH]n2)C2CCC2)cc1
Show InChI
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
1.08E+3
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Inhibition of CDK9 (unknown origin)
Citation and Details
Article DOI:
10.1016/j.bmcl.2021.128061
BindingDB Entry DOI:
10.7270/Q2348Q6B
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 9
(Homo sapiens (Human))
BDBM50570974
(CHEMBL4846069)
Show SMILES
COc1ccc(CC(=O)Nc2cc([nH]n2)C2CCC2)cc1
Show InChI
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
n/a
n/a
1.08E+3
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Blocking activity against Beta-1 adrenergic receptor in spontaneously beating guinea pig atrial preparations
Citation and Details
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 9
(Homo sapiens (Human))
BDBM50570974
(CHEMBL4846069)
Show SMILES
COc1ccc(CC(=O)Nc2cc([nH]n2)C2CCC2)cc1
Show InChI
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
n/a
n/a
1.08E+3
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Blocking activity against Beta-2 adrenergic receptor in guinea pig tracheal strips
Citation and Details
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 9
(Homo sapiens (Human))
BDBM50570974
(CHEMBL4846069)
Show SMILES
COc1ccc(CC(=O)Nc2cc([nH]n2)C2CCC2)cc1
Show InChI
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
n/a
n/a
1.08E+3
n/a
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Blocking activity against Beta-2 adrenergic receptor in guinea pig tracheal strips
Citation and Details
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 9
(Homo sapiens (Human))
BDBM50570974
(CHEMBL4846069)
Show SMILES
COc1ccc(CC(=O)Nc2cc([nH]n2)C2CCC2)cc1
Show InChI
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
PC cid
PC sid
UniChem
Article
PubMed
n/a
n/a
n/a
1.07E+3
n/a
n/a
n/a
n/a
n/a
TBA
Assay Description
Binding affinity to CDK9 (unknown origin)
Citation and Details
Article DOI:
10.1016/j.bmcl.2021.128061
BindingDB Entry DOI:
10.7270/Q2348Q6B
More data for this
Ligand-Target Pair
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