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BDBM50069583 (R)-N*1*-((S)-1-Benzylcarbamoyl-2-phenyl-ethyl)-2-cyclopentylmethyl-N*4*-hydroxy-succinamide::CHEMBL420077

SMILES: ONC(=O)C[C@@H](CC1CCCC1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1

InChI Key: InChIKey=UUKHUELBYRLVFI-PKTZIBPZSA-N

Data: 2 IC50

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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 = 50069583   
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
Immunoglobulin epsilon Fc receptor


(Homo sapiens (Human))
BDBM50069583
PNG
((R)-N*1*-((S)-1-Benzylcarbamoyl-2-phenyl-ethyl)-2-...)
Show SMILES ONC(=O)C[C@@H](CC1CCCC1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1
Show InChI InChI=1S/C26H33N3O4/c30-24(29-33)17-22(15-19-11-7-8-12-19)25(31)28-23(16-20-9-3-1-4-10-20)26(32)27-18-21-13-5-2-6-14-21/h1-6,9-10,13-14,19,22-23,33H,7-8,11-12,15-18H2,(H,27,32)(H,28,31)(H,29,30)/t22-,23+/m1/s1
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
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CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 200n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
Tested for inhibition against CD23 (IgE receptor) proteolysis in membranes derived from RPM18866 cells ( a human B-cell line)


Bioorg Med Chem Lett 8: 23-8 (1999)


BindingDB Entry DOI: 10.7270/Q2ZK5FT6
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))
BDBM50069583
PNG
((R)-N*1*-((S)-1-Benzylcarbamoyl-2-phenyl-ethyl)-2-...)
Show SMILES ONC(=O)C[C@@H](CC1CCCC1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1
Show InChI InChI=1S/C26H33N3O4/c30-24(29-33)17-22(15-19-11-7-8-12-19)25(31)28-23(16-20-9-3-1-4-10-20)26(32)27-18-21-13-5-2-6-14-21/h1-6,9-10,13-14,19,22-23,33H,7-8,11-12,15-18H2,(H,27,32)(H,28,31)(H,29,30)/t22-,23+/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

PubMed
n/an/a 20n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibitory activity towards human recombinant fibroblast collagenase


Bioorg Med Chem Lett 8: 23-8 (1999)


BindingDB Entry DOI: 10.7270/Q2ZK5FT6
More data for this
Ligand-Target Pair