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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Protein kinase C-interacting protein 1' and Ligand = 'BDBM22579'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Protein kinase C-interacting protein 1


(Rattus norvegicus)
BDBM22579
PNG
(AICAR | Aminoimidazole-4-carboxamide ribonucleotid...)
Show SMILES NC(=O)c1ncn([C@@H]2O[C@H](COP(O)(O)=O)[C@@H](O)[C@H]2O)c1N
Show InChI InChI=1S/C9H15N4O8P/c10-7-4(8(11)16)12-2-13(7)9-6(15)5(14)3(21-9)1-20-22(17,18)19/h2-3,5-6,9,14-15H,1,10H2,(H2,11,16)(H2,17,18,19)/t3-,5-,6-,9-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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CHEBI
CHEMBL
KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents


Similars

Article
PubMed
n/an/an/a 1.20E+6n/an/an/an/an/a



University of Maryland

Curated by ChEMBL


Assay Description
Binding affinity to mouse HINT1 by HSQC spectra assay


Bioorg Med Chem 18: 6756-62 (2010)


Article DOI: 10.1016/j.bmc.2010.07.051
BindingDB Entry DOI: 10.7270/Q2ZP472H
More data for this
Ligand-Target Pair
Protein kinase C-interacting protein 1


(Rattus norvegicus)
BDBM22579
PNG
(AICAR | Aminoimidazole-4-carboxamide ribonucleotid...)
Show SMILES NC(=O)c1ncn([C@@H]2O[C@H](COP(O)(O)=O)[C@@H](O)[C@H]2O)c1N
Show InChI InChI=1S/C9H15N4O8P/c10-7-4(8(11)16)12-2-13(7)9-6(15)5(14)3(21-9)1-20-22(17,18)19/h2-3,5-6,9,14-15H,1,10H2,(H2,11,16)(H2,17,18,19)/t3-,5-,6-,9-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
Purchase

CHEBI
CHEMBL
KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents


Similars

Article
PubMed
n/an/an/a 1.10E+6n/an/an/an/an/a



University of Maryland

Curated by ChEMBL


Assay Description
Binding affinity to mouse HINT1 by fluorescence quenching assay


Bioorg Med Chem 18: 6756-62 (2010)


Article DOI: 10.1016/j.bmc.2010.07.051
BindingDB Entry DOI: 10.7270/Q2ZP472H
More data for this
Ligand-Target Pair