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Found 14 hits Enz. Inhib. hit(s) with Target = 'Disintegrin and metalloproteinase domain-containing protein 33' AND taxid = 9606   
Target
(Institution)
LigandTarget
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Disintegrin and metalloproteinase domain-containing protein 33


(Homo sapiens)
BDBM26526
PNG
((2R)-N-hydroxy-2-[(3S)-3-methyl-3-{4-[(2-methylqui...)
Show SMILES C[C@@H](N1CC[C@](C)(C1=O)c1ccc(OCc2cc(C)nc3ccccc23)cc1)C(=O)NO
Show InChI InChI=1S/C25H27N3O4/c1-16-14-18(21-6-4-5-7-22(21)26-16)15-32-20-10-8-19(9-11-20)25(3)12-13-28(24(25)30)17(2)23(29)27-31/h4-11,14,17,31H,12-13,15H2,1-3H3,(H,27,29)/t17-,25+/m1/s1
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Article
PubMed
15n/an/an/an/an/an/an/an/a



University of Athens

Curated by ChEMBL


Assay Description
Inhibition of ADAM33


Citation and Details
More data for this
Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 33


(Homo sapiens)
BDBM125925
PNG
(US8772478, 14)
Show SMILES Cc1cc(COc2ccc(cc2)S(=O)(=O)NC[C@H](N2CCOCC2)C(=O)NO)c2ccccc2n1
Show InChI InChI=1S/C24H28N4O6S/c1-17-14-18(21-4-2-3-5-22(21)26-17)16-34-19-6-8-20(9-7-19)35(31,32)25-15-23(24(29)27-30)28-10-12-33-13-11-28/h2-9,14,23,25,30H,10-13,15-16H2,1H3,(H,27,29)/t23-/m0/s1
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US Patent
n/an/a 24n/an/an/an/an/an/a



Galderma Research & Development

US Patent


Assay Description
The products are solubilized in DMSO at a concentration of 10 mM. A serial 3-fold dilution over 10 points is carried out so as to have a concentratio...


US Patent US8772478 (2014)

More data for this
Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 33


(Homo sapiens)
BDBM125923
PNG
(US8772478, 15 | US8772478, 8)
Show SMILES Cc1cc(COc2ccc(cc2)S(=O)(=O)NC[C@H](N2CCCCC2)C(=O)NO)c2ccccc2n1
Show InChI InChI=1S/C25H30N4O5S/c1-18-15-19(22-7-3-4-8-23(22)27-18)17-34-20-9-11-21(12-10-20)35(32,33)26-16-24(25(30)28-31)29-13-5-2-6-14-29/h3-4,7-12,15,24,26,31H,2,5-6,13-14,16-17H2,1H3,(H,28,30)/t24-/m0/s1
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US Patent
n/an/a 26n/an/an/an/an/an/a



Galderma Research & Development

US Patent


Assay Description
The products are solubilized in DMSO at a concentration of 10 mM. A serial 3-fold dilution over 10 points is carried out so as to have a concentratio...


US Patent US8772478 (2014)

More data for this
Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 33


(Homo sapiens)
BDBM125925
PNG
(US8772478, 14)
Show SMILES Cc1cc(COc2ccc(cc2)S(=O)(=O)NC[C@H](N2CCOCC2)C(=O)NO)c2ccccc2n1
Show InChI InChI=1S/C24H28N4O6S/c1-17-14-18(21-4-2-3-5-22(21)26-17)16-34-19-6-8-20(9-7-19)35(31,32)25-15-23(24(29)27-30)28-10-12-33-13-11-28/h2-9,14,23,25,30H,10-13,15-16H2,1H3,(H,27,29)/t23-/m0/s1
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US Patent
n/an/a 38n/an/an/an/an/an/a



Galderma Research & Development

US Patent


Assay Description
The products are solubilized in DMSO at a concentration of 10 mM. A serial 3-fold dilution over 10 points is carried out so as to have a concentratio...


US Patent US8772478 (2014)

More data for this
Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 33


(Homo sapiens)
BDBM125923
PNG
(US8772478, 15 | US8772478, 8)
Show SMILES Cc1cc(COc2ccc(cc2)S(=O)(=O)NC[C@H](N2CCCCC2)C(=O)NO)c2ccccc2n1
Show InChI InChI=1S/C25H30N4O5S/c1-18-15-19(22-7-3-4-8-23(22)27-18)17-34-20-9-11-21(12-10-20)35(32,33)26-16-24(25(30)28-31)29-13-5-2-6-14-29/h3-4,7-12,15,24,26,31H,2,5-6,13-14,16-17H2,1H3,(H,28,30)/t24-/m0/s1
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US Patent
n/an/a 112n/an/an/an/an/an/a



Galderma Research & Development

US Patent


Assay Description
The products are solubilized in DMSO at a concentration of 10 mM. A serial 3-fold dilution over 10 points is carried out so as to have a concentratio...


US Patent US8772478 (2014)

More data for this
Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 33


(Homo sapiens)
BDBM125922
PNG
(US8772478, 7)
Show SMILES ONC(=O)[C@H](CNS(=O)(=O)c1ccc(OCc2ccccc2)cc1)N1CCOCC1
Show InChI InChI=1S/C20H25N3O6S/c24-20(22-25)19(23-10-12-28-13-11-23)14-21-30(26,27)18-8-6-17(7-9-18)29-15-16-4-2-1-3-5-16/h1-9,19,21,25H,10-15H2,(H,22,24)/t19-/m0/s1
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US Patent
n/an/a 147n/an/an/an/an/an/a



Galderma Research & Development

US Patent


Assay Description
The products are solubilized in DMSO at a concentration of 10 mM. A serial 3-fold dilution over 10 points is carried out so as to have a concentratio...


US Patent US8772478 (2014)

More data for this
Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 33


(Homo sapiens)
BDBM125917
PNG
(US8772478, 1)
Show SMILES ONC(=O)[C@H](CNS(=O)(=O)c1ccc(OCc2ccccc2)cc1)N1CCCCC1
Show InChI InChI=1S/C21H27N3O5S/c25-21(23-26)20(24-13-5-2-6-14-24)15-22-30(27,28)19-11-9-18(10-12-19)29-16-17-7-3-1-4-8-17/h1,3-4,7-12,20,22,26H,2,5-6,13-16H2,(H,23,25)/t20-/m0/s1
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US Patent
n/an/a 181n/an/an/an/an/an/a



Galderma Research & Development

US Patent


Assay Description
The products are solubilized in DMSO at a concentration of 10 mM. A serial 3-fold dilution over 10 points is carried out so as to have a concentratio...


US Patent US8772478 (2014)

More data for this
Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 33


(Homo sapiens)
BDBM125919
PNG
(US8772478, 3)
Show SMILES ONC(=O)[C@H](CNS(=O)(=O)c1ccc(OCc2ccc(F)cc2)cc1)N1CCCCC1
Show InChI InChI=1S/C21H26FN3O5S/c22-17-6-4-16(5-7-17)15-30-18-8-10-19(11-9-18)31(28,29)23-14-20(21(26)24-27)25-12-2-1-3-13-25/h4-11,20,23,27H,1-3,12-15H2,(H,24,26)/t20-/m0/s1
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US Patent
n/an/a 181n/an/an/an/an/an/a



Galderma Research & Development

US Patent


Assay Description
The products are solubilized in DMSO at a concentration of 10 mM. A serial 3-fold dilution over 10 points is carried out so as to have a concentratio...


US Patent US8772478 (2014)

More data for this
Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 33


(Homo sapiens)
BDBM125920
PNG
(US8772478, 5)
Show SMILES ONC(=O)[C@H](CNS(=O)(=O)c1ccc(OCc2ccc3ccccc3c2)cc1)N1CCCCC1
Show InChI InChI=1S/C25H29N3O5S/c29-25(27-30)24(28-14-4-1-5-15-28)17-26-34(31,32)23-12-10-22(11-13-23)33-18-19-8-9-20-6-2-3-7-21(20)16-19/h2-3,6-13,16,24,26,30H,1,4-5,14-15,17-18H2,(H,27,29)/t24-/m0/s1
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US Patent
n/an/a 249n/an/an/an/an/an/a



Galderma Research & Development

US Patent


Assay Description
The products are solubilized in DMSO at a concentration of 10 mM. A serial 3-fold dilution over 10 points is carried out so as to have a concentratio...


US Patent US8772478 (2014)

More data for this
Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 33


(Homo sapiens)
BDBM125918
PNG
(US8772478, 2)
Show SMILES ONC(=O)[C@H](CNS(=O)(=O)c1ccc(OCc2ccccc2)cc1)N1CCCC1
Show InChI InChI=1S/C20H25N3O5S/c24-20(22-25)19(23-12-4-5-13-23)14-21-29(26,27)18-10-8-17(9-11-18)28-15-16-6-2-1-3-7-16/h1-3,6-11,19,21,25H,4-5,12-15H2,(H,22,24)/t19-/m0/s1
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US Patent
n/an/a 298n/an/an/an/an/an/a



Galderma Research & Development

US Patent


Assay Description
The products are solubilized in DMSO at a concentration of 10 mM. A serial 3-fold dilution over 10 points is carried out so as to have a concentratio...


US Patent US8772478 (2014)

More data for this
Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 33


(Homo sapiens)
BDBM125921
PNG
(US8772478, 6)
Show SMILES ONC(=O)[C@H](CNS(=O)(=O)c1ccc(OCc2ccc(Cl)c(Cl)c2)cc1)N1CCCCC1
Show InChI InChI=1S/C21H25Cl2N3O5S/c22-18-9-4-15(12-19(18)23)14-31-16-5-7-17(8-6-16)32(29,30)24-13-20(21(27)25-28)26-10-2-1-3-11-26/h4-9,12,20,24,28H,1-3,10-11,13-14H2,(H,25,27)/t20-/m0/s1
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US Patent
n/an/a 328n/an/an/an/an/an/a



Galderma Research & Development

US Patent


Assay Description
The products are solubilized in DMSO at a concentration of 10 mM. A serial 3-fold dilution over 10 points is carried out so as to have a concentratio...


US Patent US8772478 (2014)

More data for this
Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 33


(Homo sapiens)
BDBM125924
PNG
(US8772478, 9)
Show SMILES ONC(=O)[C@H](CNS(=O)(=O)c1ccc(OCc2cc(Cl)cc(Cl)c2)cc1)N1CCCCC1
Show InChI InChI=1S/C21H25Cl2N3O5S/c22-16-10-15(11-17(23)12-16)14-31-18-4-6-19(7-5-18)32(29,30)24-13-20(21(27)25-28)26-8-2-1-3-9-26/h4-7,10-12,20,24,28H,1-3,8-9,13-14H2,(H,25,27)/t20-/m0/s1
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US Patent
n/an/a 469n/an/an/an/an/an/a



Galderma Research & Development

US Patent


Assay Description
The products are solubilized in DMSO at a concentration of 10 mM. A serial 3-fold dilution over 10 points is carried out so as to have a concentratio...


US Patent US8772478 (2014)

More data for this
Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 33


(Homo sapiens)
BDBM50203527
PNG
((6S,7S)-methyl 7-(hydroxycarbamoyl)-6-(4-phenyl-1,...)
Show SMILES COC(=O)N1CC2(CC2)C[C@@H]([C@H]1C(=O)N1CCC(=CC1)c1ccccc1)C(=O)NO
Show InChI InChI=1S/C22H27N3O5/c1-30-21(28)25-14-22(9-10-22)13-17(19(26)23-29)18(25)20(27)24-11-7-16(8-12-24)15-5-3-2-4-6-15/h2-7,17-18,29H,8-14H2,1H3,(H,23,26)/t17-,18-/m0/s1
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Article
PubMed
n/an/a 1.03E+3n/an/an/an/an/an/a



University of Athens

Curated by ChEMBL


Assay Description
Inhibition of ADAM33


Citation and Details
More data for this
Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 33


(Homo sapiens)
BDBM50265157
PNG
((6S,7S)-N-hydroxy-5-methyl-6-(4-(5-(trifluoromethy...)
Show SMILES CN1CC2(CC2)C[C@@H]([C@H]1C(=O)N1CCN(CC1)c1ccc(cn1)C(F)(F)F)C(=O)NO
Show InChI InChI=1S/C20H26F3N5O3/c1-26-12-19(4-5-19)10-14(17(29)25-31)16(26)18(30)28-8-6-27(7-9-28)15-3-2-13(11-24-15)20(21,22)23/h2-3,11,14,16,31H,4-10,12H2,1H3,(H,25,29)/t14-,16-/m0/s1
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Article
PubMed
n/an/a 4.13E+3n/an/an/an/an/an/a



University of Athens

Curated by ChEMBL


Assay Description
Inhibition of ADAM33


Citation and Details
More data for this
Ligand-Target Pair