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BDBM50288710 (R)-2-[(S)-1-((S)-3-Methyl-1-phenylcarbamoyl-butylcarbamoyl)-3-phenyl-propylamino]-5-(3-phenyl-propionylamino)-pentanoic acid::CHEMBL333831

SMILES: CC(C)C[C@H](NC(=O)[C@H](CCc1ccccc1)N[C@H](CCCNC(=O)CCc1ccccc1)C(O)=O)C(=O)Nc1ccccc1

InChI Key: InChIKey=FYBKBNVRCAQIIE-QAXCHELISA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50288710   
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))
BDBM50288710
PNG
((R)-2-[(S)-1-((S)-3-Methyl-1-phenylcarbamoyl-butyl...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCc1ccccc1)N[C@H](CCCNC(=O)CCc1ccccc1)C(O)=O)C(=O)Nc1ccccc1
Show InChI InChI=1S/C36H46N4O5/c1-26(2)25-32(35(43)38-29-17-10-5-11-18-29)40-34(42)30(22-20-27-13-6-3-7-14-27)39-31(36(44)45)19-12-24-37-33(41)23-21-28-15-8-4-9-16-28/h3-11,13-18,26,30-32,39H,12,19-25H2,1-2H3,(H,37,41)(H,38,43)(H,40,42)(H,44,45)/t30-,31+,32-/m0/s1
PDB
MMDB

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UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem
Article
9.5n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of MMP-3.


Bioorg Med Chem Lett 6: 329-332 (1996)


Article DOI: 10.1016/0960-894X(96)00024-8
BindingDB Entry DOI: 10.7270/Q2S75GBB
More data for this
Ligand-Target Pair
Matrix metalloproteinase-1 (MMP1)


(Homo sapiens (Human))
BDBM50288710
PNG
((R)-2-[(S)-1-((S)-3-Methyl-1-phenylcarbamoyl-butyl...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCc1ccccc1)N[C@H](CCCNC(=O)CCc1ccccc1)C(O)=O)C(=O)Nc1ccccc1
Show InChI InChI=1S/C36H46N4O5/c1-26(2)25-32(35(43)38-29-17-10-5-11-18-29)40-34(42)30(22-20-27-13-6-3-7-14-27)39-31(36(44)45)19-12-24-37-33(41)23-21-28-15-8-4-9-16-28/h3-11,13-18,26,30-32,39H,12,19-25H2,1-2H3,(H,37,41)(H,38,43)(H,40,42)(H,44,45)/t30-,31+,32-/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
2.20E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of matrix metalloproteinase -1.


Bioorg Med Chem Lett 6: 329-332 (1996)


Article DOI: 10.1016/0960-894X(96)00024-8
BindingDB Entry DOI: 10.7270/Q2S75GBB
More data for this
Ligand-Target Pair