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SMILES: COC(=O)CCP(O)(=O)C[C@@H](CCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)Nc1ccccc1

InChI Key: InChIKey=WRARKZOMOGNDCB-VWNXMTODSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50288676   
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
Stromelysin-1


(Homo sapiens (Human))
BDBM50288676
PNG
(3-{Hydroxy-[(S)-2-((S)-3-methyl-1-phenylcarbamoyl-...)
Show SMILES COC(=O)CCP(O)(=O)C[C@@H](CCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)Nc1ccccc1
Show InChI InChI=1S/C27H37N2O6P/c1-20(2)18-24(27(32)28-23-12-8-5-9-13-23)29-26(31)22(15-14-21-10-6-4-7-11-21)19-36(33,34)17-16-25(30)35-3/h4-13,20,22,24H,14-19H2,1-3H3,(H,28,32)(H,29,31)(H,33,34)/t22-,24+/m1/s1
PDB
MMDB

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PC cid
PC sid
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Similars

Article
520n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of stromelysin-1 (MMP-3).


Bioorg Med Chem Lett 6: 323-328 (1996)


Article DOI: 10.1016/0960-894X(96)00023-6
BindingDB Entry DOI: 10.7270/Q2X0671M
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))
BDBM50288676
PNG
(3-{Hydroxy-[(S)-2-((S)-3-methyl-1-phenylcarbamoyl-...)
Show SMILES COC(=O)CCP(O)(=O)C[C@@H](CCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)Nc1ccccc1
Show InChI InChI=1S/C27H37N2O6P/c1-20(2)18-24(27(32)28-23-12-8-5-9-13-23)29-26(31)22(15-14-21-10-6-4-7-11-21)19-36(33,34)17-16-25(30)35-3/h4-13,20,22,24H,14-19H2,1-3H3,(H,28,32)(H,29,31)(H,33,34)/t22-,24+/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
1.30E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of gelatinase-A (MMP-2).


Bioorg Med Chem Lett 6: 323-328 (1996)


Article DOI: 10.1016/0960-894X(96)00023-6
BindingDB Entry DOI: 10.7270/Q2X0671M
More data for this
Ligand-Target Pair