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SMILES: CC(C)C[C@H](CC(=O)NO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)c1nc2ccccc2[nH]1

InChI Key: InChIKey=UVBJVUYVRZYYHC-ZHRRBRCNSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50287385   
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))
BDBM50287385
PNG
((R)-N*1*-[1-(1H-Benzoimidazol-2-yl)-2-(1H-indol-3-...)
Show SMILES CC(C)C[C@H](CC(=O)NO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)c1nc2ccccc2[nH]1
Show InChI InChI=1S/C25H29N5O3/c1-15(2)11-16(13-23(31)30-33)25(32)29-22(24-27-20-9-5-6-10-21(20)28-24)12-17-14-26-19-8-4-3-7-18(17)19/h3-10,14-16,22,26,33H,11-13H2,1-2H3,(H,27,28)(H,29,32)(H,30,31)/t16-,22+/m1/s1
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Article
n/an/a 29n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of human fibroblast stromelysin, matrix metalloproteinase-3


Bioorg Med Chem Lett 6: 1601-1606 (1996)


Article DOI: 10.1016/S0960-894X(96)00283-1
BindingDB Entry DOI: 10.7270/Q2WD40JH
More data for this
Ligand-Target Pair
Matrilysin


(Homo sapiens (Human))
BDBM50287385
PNG
((R)-N*1*-[1-(1H-Benzoimidazol-2-yl)-2-(1H-indol-3-...)
Show SMILES CC(C)C[C@H](CC(=O)NO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)c1nc2ccccc2[nH]1
Show InChI InChI=1S/C25H29N5O3/c1-15(2)11-16(13-23(31)30-33)25(32)29-22(24-27-20-9-5-6-10-21(20)28-24)12-17-14-26-19-8-4-3-7-18(17)19/h3-10,14-16,22,26,33H,11-13H2,1-2H3,(H,27,28)(H,29,32)(H,30,31)/t16-,22+/m1/s1
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Article
n/an/a 10n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of matrilysin, matrix metalloproteinase-7


Bioorg Med Chem Lett 6: 1601-1606 (1996)


Article DOI: 10.1016/S0960-894X(96)00283-1
BindingDB Entry DOI: 10.7270/Q2WD40JH
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))
BDBM50287385
PNG
((R)-N*1*-[1-(1H-Benzoimidazol-2-yl)-2-(1H-indol-3-...)
Show SMILES CC(C)C[C@H](CC(=O)NO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)c1nc2ccccc2[nH]1
Show InChI InChI=1S/C25H29N5O3/c1-15(2)11-16(13-23(31)30-33)25(32)29-22(24-27-20-9-5-6-10-21(20)28-24)12-17-14-26-19-8-4-3-7-18(17)19/h3-10,14-16,22,26,33H,11-13H2,1-2H3,(H,27,28)(H,29,32)(H,30,31)/t16-,22+/m1/s1
PDB
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UniProtKB/SwissProt

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antibodypedia
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PC sid
UniChem

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Article
n/an/a 22n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of human fibroblast collagenase, matrix metalloproteinase-1


Bioorg Med Chem Lett 6: 1601-1606 (1996)


Article DOI: 10.1016/S0960-894X(96)00283-1
BindingDB Entry DOI: 10.7270/Q2WD40JH
More data for this
Ligand-Target Pair