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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Cytidine deaminase' and Ligand = 'BDBM50366985'   
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
Cytidine deaminase


(Homo sapiens (Human))
BDBM50366985
PNG
(CHEMBL608656)
Show SMILES OC[C@H]1OC([C@H](O)[C@@H]1O)N1CCNC(=O)C1 |r|
Show InChI InChI=1S/C9H16N2O5/c12-4-5-7(14)8(15)9(16-5)11-2-1-10-6(13)3-11/h5,7-9,12,14-15H,1-4H2,(H,10,13)/t5-,7-,8-,9?/m1/s1
PDB
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PC cid
PC sid
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2.80E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against cytidine deaminase of human liver


J Med Chem 24: 662-6 (1981)


BindingDB Entry DOI: 10.7270/Q2JM2B6C
More data for this
Ligand-Target Pair
Cytidine deaminase


(Mus musculus)
BDBM50366985
PNG
(CHEMBL608656)
Show SMILES OC[C@H]1OC([C@H](O)[C@@H]1O)N1CCNC(=O)C1 |r|
Show InChI InChI=1S/C9H16N2O5/c12-4-5-7(14)8(15)9(16-5)11-2-1-10-6(13)3-11/h5,7-9,12,14-15H,1-4H2,(H,10,13)/t5-,7-,8-,9?/m1/s1
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
4.00E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against cytidine deaminase of mouse kidney


J Med Chem 24: 662-6 (1981)


BindingDB Entry DOI: 10.7270/Q2JM2B6C
More data for this
Ligand-Target Pair
Cytidine deaminase


(Mus musculus)
BDBM50366985
PNG
(CHEMBL608656)
Show SMILES OC[C@H]1OC([C@H](O)[C@@H]1O)N1CCNC(=O)C1 |r|
Show InChI InChI=1S/C9H16N2O5/c12-4-5-7(14)8(15)9(16-5)11-2-1-10-6(13)3-11/h5,7-9,12,14-15H,1-4H2,(H,10,13)/t5-,7-,8-,9?/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
4.00E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Cytidine Deaminase Inhibition in mouse Kidney


J Med Chem 23: 713-5 (1980)

Checked by Author
BindingDB Entry DOI: 10.7270/Q23N23ZN
More data for this
Ligand-Target Pair