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1 similar compounds to monomer 50082965

Wt: 485.5
BDBM50082953

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50082953   
Target
(Institution)
LigandTarget
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
Matrix metalloproteinase-1 (MMP1)


(homo sapiens (human))
BDBM50082953
PNG
((2R,3S)-N*1*-((S)-2,2-Dimethyl-1-methylcarbamoyl-p...)
Show SMILES CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[C@H](NC(=O)c1cccc2cccnc12)C(=O)NO)C(C)(C)C
Show InChI InChI=1S/C25H35N5O5/c1-14(2)13-17(22(32)29-20(24(34)26-6)25(3,4)5)19(23(33)30-35)28-21(31)16-11-7-9-15-10-8-12-27-18(15)16/h7-12,14,17,19-20,35H,13H2,1-6H3,(H,26,34)(H,28,31)(H,29,32)(H,30,33)/t17-,19+,20-/m1/s1
PDB
MMDB

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PC cid
PC sid
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AffyNet 
PubMed
n/an/a 2.20n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibitory activity against MMP-1 (Matrix metalloproteinase-1)


J Med Chem 42: 4890-908 (1999)

More data for this
Ligand-Target Pair
ADAM17


(Homo sapiens (Human))
BDBM50082953
PNG
((2R,3S)-N*1*-((S)-2,2-Dimethyl-1-methylcarbamoyl-p...)
Show SMILES CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[C@H](NC(=O)c1cccc2cccnc12)C(=O)NO)C(C)(C)C
Show InChI InChI=1S/C25H35N5O5/c1-14(2)13-17(22(32)29-20(24(34)26-6)25(3,4)5)19(23(33)30-35)28-21(31)16-11-7-9-15-10-8-12-27-18(15)16/h7-12,14,17,19-20,35H,13H2,1-6H3,(H,26,34)(H,28,31)(H,29,32)(H,30,33)/t17-,19+,20-/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

AffyNet 
PubMed
n/an/a 8.00E+3n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of TNF(tumor necrosis factor) in human blood


J Med Chem 42: 4890-908 (1999)

More data for this
Ligand-Target Pair
ADAM17


(Homo sapiens (Human))
BDBM50082953
PNG
((2R,3S)-N*1*-((S)-2,2-Dimethyl-1-methylcarbamoyl-p...)
Show SMILES CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[C@H](NC(=O)c1cccc2cccnc12)C(=O)NO)C(C)(C)C
Show InChI InChI=1S/C25H35N5O5/c1-14(2)13-17(22(32)29-20(24(34)26-6)25(3,4)5)19(23(33)30-35)28-21(31)16-11-7-9-15-10-8-12-27-18(15)16/h7-12,14,17,19-20,35H,13H2,1-6H3,(H,26,34)(H,28,31)(H,29,32)(H,30,33)/t17-,19+,20-/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

AffyNet 
PubMed
n/an/a 2n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibitory activity against Tumor necrosis factor alpha-converting enzyme (TACE) in blood.


J Med Chem 42: 4890-908 (1999)

More data for this
Ligand-Target Pair