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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Aminopeptidase N' and Ligand = 'BDBM50001947'   
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
Aminopeptidase N


(Sus scrofa (Pig))
BDBM50001947
PNG
(2-(3,7-Diamino-2-hydroxy-heptanoylamino)-3-[2-(2-n...)
Show SMILES COC(=O)[C@@H](Cc1c(Sc2ccccc2[N+]([O-])=O)[nH]c2ccccc12)NC(=O)C(O)[C@H](N)CCCCN
Show InChI InChI=1S/C25H31N5O6S/c1-36-25(33)19(28-23(32)22(31)17(27)9-6-7-13-26)14-16-15-8-2-3-10-18(15)29-24(16)37-21-12-5-4-11-20(21)30(34)35/h2-5,8,10-12,17,19,22,29,31H,6-7,9,13-14,26-27H2,1H3,(H,28,32)/t17-,19-,22?/m1/s1
PDB

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 330n/an/an/an/an/an/a



Instituto de Qu£mica M£dica

Curated by ChEMBL


Assay Description
Compound was evaluated for its inhibitory potency against purified membrane bound rat brain aminopeptidase


J Med Chem 35: 889-95 (1992)


Article DOI: 10.1021/jm00083a013
BindingDB Entry DOI: 10.7270/Q2X92BWN
More data for this
Ligand-Target Pair
Aminopeptidase N


(Rattus norvegicus)
BDBM50001947
PNG
(2-(3,7-Diamino-2-hydroxy-heptanoylamino)-3-[2-(2-n...)
Show SMILES COC(=O)[C@@H](Cc1c(Sc2ccccc2[N+]([O-])=O)[nH]c2ccccc12)NC(=O)C(O)[C@H](N)CCCCN
Show InChI InChI=1S/C25H31N5O6S/c1-36-25(33)19(28-23(32)22(31)17(27)9-6-7-13-26)14-16-15-8-2-3-10-18(15)29-24(16)37-21-12-5-4-11-20(21)30(34)35/h2-5,8,10-12,17,19,22,29,31H,6-7,9,13-14,26-27H2,1H3,(H,28,32)/t17-,19-,22?/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 9.12E+4n/an/an/an/an/an/a



Instituto de Qu£mica M£dica

Curated by ChEMBL


Assay Description
Compound was evaluated for its inhibitory potency against purified membrane bound rat brain Aminopeptidase M (AP-M) using [3H]Leu-enkephalin as subst...


J Med Chem 35: 889-95 (1992)


Article DOI: 10.1021/jm00083a013
BindingDB Entry DOI: 10.7270/Q2X92BWN
More data for this
Ligand-Target Pair