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BDBM50298247 CHEMBL573367::N-Hydroxy-5-(3-nitroguanidino)-2-(3-phenylpropanamido)pentanamide

SMILES: NC(NCCC[C@H](NC(=O)CCc1ccccc1)C(=O)NO)=N[N+]([O-])=O

InChI Key: InChIKey=FQILLAQMOCATFH-LBPRGKRZSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50298247   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
72 kDa type IV collagenase


(Homo sapiens (Human))
BDBM50298247
PNG
(CHEMBL573367 | N-Hydroxy-5-(3-nitroguanidino)-2-(3...)
Show SMILES NC(NCCC[C@H](NC(=O)CCc1ccccc1)C(=O)NO)=N[N+]([O-])=O |r,w:22.23|
Show InChI InChI=1S/C15H22N6O5/c16-15(19-21(25)26)17-10-4-7-12(14(23)20-24)18-13(22)9-8-11-5-2-1-3-6-11/h1-3,5-6,12,24H,4,7-10H2,(H,18,22)(H,20,23)(H3,16,17,19)/t12-/m0/s1
PDB
MMDB

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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.64E+6n/an/an/an/an/an/a



Shandong University

Curated by ChEMBL


Assay Description
Inhibition of MMP2


Bioorg Med Chem 17: 4666-73 (2009)


Article DOI: 10.1016/j.bmc.2009.04.056
BindingDB Entry DOI: 10.7270/Q2D21XN3
More data for this
Ligand-Target Pair
Aminopeptidase N


(Sus scrofa (Pig))
BDBM50298247
PNG
(CHEMBL573367 | N-Hydroxy-5-(3-nitroguanidino)-2-(3...)
Show SMILES NC(NCCC[C@H](NC(=O)CCc1ccccc1)C(=O)NO)=N[N+]([O-])=O |r,w:22.23|
Show InChI InChI=1S/C15H22N6O5/c16-15(19-21(25)26)17-10-4-7-12(14(23)20-24)18-13(22)9-8-11-5-2-1-3-6-11/h1-3,5-6,12,24H,4,7-10H2,(H,18,22)(H,20,23)(H3,16,17,19)/t12-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.32E+5n/an/an/an/an/an/a



Shandong University

Curated by ChEMBL


Assay Description
Inhibition of aminopeptidase N in pig kidney microsome by spectrophotometry


Bioorg Med Chem 17: 4666-73 (2009)


Article DOI: 10.1016/j.bmc.2009.04.056
BindingDB Entry DOI: 10.7270/Q2D21XN3
More data for this
Ligand-Target Pair