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SMILES: ONC(=O)[C@H](CNC(=O)c1ccc(OCc2ccnc(c2)-c2ccccc2)cc1)N1CCCCC1

InChI Key: InChIKey=HMKOPGQRIXEHTH-VWLOTQADSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 207966   
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
Disintegrin and metalloproteinase domain-containing protein 17


(Homo sapiens (Human))
BDBM207966
PNG
(US9266848, 4)
Show SMILES ONC(=O)[C@H](CNC(=O)c1ccc(OCc2ccnc(c2)-c2ccccc2)cc1)N1CCCCC1
Show InChI InChI=1S/C27H30N4O4/c32-26(29-18-25(27(33)30-34)31-15-5-2-6-16-31)22-9-11-23(12-10-22)35-19-20-13-14-28-24(17-20)21-7-3-1-4-8-21/h1,3-4,7-14,17,25,34H,2,5-6,15-16,18-19H2,(H,29,32)(H,30,33)/t25-/m0/s1
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n/an/a 61n/an/an/an/a7.437



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The TACE enzyme is an internal production (carried out according to the publication Protein Eng Des Sel, 2006, 19, 155-161) and is added so as to hav...


US Patent US9266848 (2016)


BindingDB Entry DOI: 10.7270/Q2TM78ZS
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))
BDBM207966
PNG
(US9266848, 4)
Show SMILES ONC(=O)[C@H](CNC(=O)c1ccc(OCc2ccnc(c2)-c2ccccc2)cc1)N1CCCCC1
Show InChI InChI=1S/C27H30N4O4/c32-26(29-18-25(27(33)30-34)31-15-5-2-6-16-31)22-9-11-23(12-10-22)35-19-20-13-14-28-24(17-20)21-7-3-1-4-8-21/h1,3-4,7-14,17,25,34H,2,5-6,15-16,18-19H2,(H,29,32)(H,30,33)/t25-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The molecules are tested in dose-response studies on the following enzymes MMP1, MMP3, MMP9, ADAM9 and ADAM10 according to the same protocol as that ...


US Patent US9266848 (2016)


BindingDB Entry DOI: 10.7270/Q2TM78ZS
More data for this
Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 10


(Homo sapiens (Human))
BDBM207966
PNG
(US9266848, 4)
Show SMILES ONC(=O)[C@H](CNC(=O)c1ccc(OCc2ccnc(c2)-c2ccccc2)cc1)N1CCCCC1
Show InChI InChI=1S/C27H30N4O4/c32-26(29-18-25(27(33)30-34)31-15-5-2-6-16-31)22-9-11-23(12-10-22)35-19-20-13-14-28-24(17-20)21-7-3-1-4-8-21/h1,3-4,7-14,17,25,34H,2,5-6,15-16,18-19H2,(H,29,32)(H,30,33)/t25-/m0/s1
PDB

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PC sid
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US Patent
n/an/a>1.00E+4n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The molecules are tested in dose-response studies on the following enzymes MMP1, MMP3, MMP9, ADAM9 and ADAM10 according to the same protocol as that ...


US Patent US9266848 (2016)


BindingDB Entry DOI: 10.7270/Q2TM78ZS
More data for this
Ligand-Target Pair
Matrix metalloproteinase-9


(Homo sapiens (Human))
BDBM207966
PNG
(US9266848, 4)
Show SMILES ONC(=O)[C@H](CNC(=O)c1ccc(OCc2ccnc(c2)-c2ccccc2)cc1)N1CCCCC1
Show InChI InChI=1S/C27H30N4O4/c32-26(29-18-25(27(33)30-34)31-15-5-2-6-16-31)22-9-11-23(12-10-22)35-19-20-13-14-28-24(17-20)21-7-3-1-4-8-21/h1,3-4,7-14,17,25,34H,2,5-6,15-16,18-19H2,(H,29,32)(H,30,33)/t25-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The molecules are tested in dose-response studies on the following enzymes MMP1, MMP3, MMP9, ADAM9 and ADAM10 according to the same protocol as that ...


US Patent US9266848 (2016)


BindingDB Entry DOI: 10.7270/Q2TM78ZS
More data for this
Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 9


(Homo sapiens (Human))
BDBM207966
PNG
(US9266848, 4)
Show SMILES ONC(=O)[C@H](CNC(=O)c1ccc(OCc2ccnc(c2)-c2ccccc2)cc1)N1CCCCC1
Show InChI InChI=1S/C27H30N4O4/c32-26(29-18-25(27(33)30-34)31-15-5-2-6-16-31)22-9-11-23(12-10-22)35-19-20-13-14-28-24(17-20)21-7-3-1-4-8-21/h1,3-4,7-14,17,25,34H,2,5-6,15-16,18-19H2,(H,29,32)(H,30,33)/t25-/m0/s1
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>1.00E+4n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The molecules are tested in dose-response studies on the following enzymes MMP1, MMP3, MMP9, ADAM9 and ADAM10 according to the same protocol as that ...


US Patent US9266848 (2016)


BindingDB Entry DOI: 10.7270/Q2TM78ZS
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))
BDBM207966
PNG
(US9266848, 4)
Show SMILES ONC(=O)[C@H](CNC(=O)c1ccc(OCc2ccnc(c2)-c2ccccc2)cc1)N1CCCCC1
Show InChI InChI=1S/C27H30N4O4/c32-26(29-18-25(27(33)30-34)31-15-5-2-6-16-31)22-9-11-23(12-10-22)35-19-20-13-14-28-24(17-20)21-7-3-1-4-8-21/h1,3-4,7-14,17,25,34H,2,5-6,15-16,18-19H2,(H,29,32)(H,30,33)/t25-/m0/s1
PDB
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UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
n/an/a>1.00E+4n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The molecules are tested in dose-response studies on the following enzymes MMP1, MMP3, MMP9, ADAM9 and ADAM10 according to the same protocol as that ...


US Patent US9266848 (2016)


BindingDB Entry DOI: 10.7270/Q2TM78ZS
More data for this
Ligand-Target Pair