Found 135 hits with Last Name = 'stam' and Initial = 'ej' Target/Host
(Institution) | Ligand | Target/Host
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 | pH | Temp
°C |
|---|
Collagenase 3
(Homo sapiens (Human)) | BDBM50118975
(4-(4-Methoxy-benzenesulfonyl)-1-(thiophene-2-carbo...)Show SMILES COc1ccc(cc1)S(=O)(=O)N1Cc2ccccc2N(CC1C(=O)NO)C(=O)c1cccs1 Show InChI InChI=1S/C22H21N3O6S2/c1-31-16-8-10-17(11-9-16)33(29,30)25-13-15-5-2-3-6-18(15)24(14-19(25)21(26)23-28)22(27)20-7-4-12-32-20/h2-12,19,28H,13-14H2,1H3,(H,23,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 1 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
In vitro inhibition of matrix metalloprotease-13. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50099465
((R)-1-[4-(4-Fluoro-phenoxy)-benzyl]-2-oxo-imidazol...)Show SMILES ONC(=O)[C@H]1CN(Cc2ccc(Oc3ccc(F)cc3)cc2)C(=O)N1 Show InChI InChI=1S/C17H16FN3O4/c18-12-3-7-14(8-4-12)25-13-5-1-11(2-6-13)9-21-10-15(16(22)20-24)19-17(21)23/h1-8,15,24H,9-10H2,(H,19,23)(H,20,22)/t15-/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research & Development
Curated by ChEMBL
| Assay Description
Inhibition of Matrix metalloproteinase-13 |
Bioorg Med Chem Lett 11: 1211-3 (2001)
BindingDB Entry DOI: 10.7270/Q2BC3XTK |
More data for this
Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50132632
((2R,3S)-4-Acetyl-3-methyl-1-[4-(2-methyl-benzyloxy...)Show SMILES C[C@H]1[C@@H](N(CCN1C(C)=O)S(=O)(=O)c1ccc(OCc2ccccc2C)cc1)C(=O)NO Show InChI InChI=1S/C22H27N3O6S/c1-15-6-4-5-7-18(15)14-31-19-8-10-20(11-9-19)32(29,30)25-13-12-24(17(3)26)16(2)21(25)22(27)23-28/h4-11,16,21,28H,12-14H2,1-3H3,(H,23,27)/t16-,21+/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
In vitro inhibition of matrix metalloprotease-13. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50132620
((2R,3S)-4-Acetyl-1-[4-(4-fluoro-benzyloxy)-benzene...)Show SMILES C[C@H]1[C@@H](N(CCN1C(C)=O)S(=O)(=O)c1ccc(OCc2ccc(F)cc2)cc1)C(=O)NO Show InChI InChI=1S/C21H24FN3O6S/c1-14-20(21(27)23-28)25(12-11-24(14)15(2)26)32(29,30)19-9-7-18(8-10-19)31-13-16-3-5-17(22)6-4-16/h3-10,14,20,28H,11-13H2,1-2H3,(H,23,27)/t14-,20+/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
In vitro inhibition of matrix metalloprotease-13. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50099466
((R)-1-[4-(Naphthalen-2-yloxy)-benzyl]-2-oxo-imidaz...)Show SMILES ONC(=O)[C@H]1CN(Cc2ccc(Oc3ccc4ccccc4c3)cc2)C(=O)N1 Show InChI InChI=1S/C21H19N3O4/c25-20(23-27)19-13-24(21(26)22-19)12-14-5-8-17(9-6-14)28-18-10-7-15-3-1-2-4-16(15)11-18/h1-11,19,27H,12-13H2,(H,22,26)(H,23,25)/t19-/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research & Development
Curated by ChEMBL
| Assay Description
Inhibition of Matrix metalloproteinase-13 |
Bioorg Med Chem Lett 11: 1211-3 (2001)
BindingDB Entry DOI: 10.7270/Q2BC3XTK |
More data for this
Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50132625
((2S,3R)-3-Hydroxycarbamoyl-2-methyl-4-[4-(2-methyl...)Show SMILES COC(=O)N1CCN([C@H]([C@@H]1C)C(=O)NO)S(=O)(=O)c1ccc(OCc2ccccc2C)cc1 Show InChI InChI=1S/C22H27N3O7S/c1-15-6-4-5-7-17(15)14-32-18-8-10-19(11-9-18)33(29,30)25-13-12-24(22(27)31-3)16(2)20(25)21(26)23-28/h4-11,16,20,28H,12-14H2,1-3H3,(H,23,26)/t16-,20+/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
In vitro inhibition of matrix metalloprotease-13. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50132628
((2R,3S)-4-Methanesulfonyl-3-methyl-1-[4-(2-methyl-...)Show SMILES C[C@H]1[C@@H](N(CCN1S(C)(=O)=O)S(=O)(=O)c1ccc(OCc2ccccc2C)cc1)C(=O)NO Show InChI InChI=1S/C21H27N3O7S2/c1-15-6-4-5-7-17(15)14-31-18-8-10-19(11-9-18)33(29,30)24-13-12-23(32(3,27)28)16(2)20(24)21(25)22-26/h4-11,16,20,26H,12-14H2,1-3H3,(H,22,25)/t16-,20+/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
In vitro inhibition of matrix metalloprotease-13. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50132638
((2S,3R)-2-Methyl-4-[4-(2-methyl-benzyloxy)-benzene...)Show SMILES CC(C)NC(=O)N1CCN([C@H]([C@@H]1C)C(=O)NO)S(=O)(=O)c1ccc(OCc2ccccc2C)cc1 Show InChI InChI=1S/C24H32N4O6S/c1-16(2)25-24(30)27-13-14-28(22(18(27)4)23(29)26-31)35(32,33)21-11-9-20(10-12-21)34-15-19-8-6-5-7-17(19)3/h5-12,16,18,22,31H,13-15H2,1-4H3,(H,25,30)(H,26,29)/t18-,22+/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
In vitro inhibition of matrix metalloprotease-13. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Disintegrin and metalloproteinase domain-containing protein 17
(Homo sapiens (Human)) | BDBM50132634
((2R,3S)-4-Acetyl-3-methyl-1-[4-(2-methyl-pyridin-3...)Show SMILES C[C@H]1[C@@H](N(CCN1C(C)=O)S(=O)(=O)c1ccc(OCc2cccnc2C)cc1)C(=O)NO Show InChI InChI=1S/C21H26N4O6S/c1-14-17(5-4-10-22-14)13-31-18-6-8-19(9-7-18)32(29,30)25-12-11-24(16(3)26)15(2)20(25)21(27)23-28/h4-10,15,20,28H,11-13H2,1-3H3,(H,23,27)/t15-,20+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant tumor necrosis factor-alpha converting enzyme. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Disintegrin and metalloproteinase domain-containing protein 17
(Homo sapiens (Human)) | BDBM50132636
((2R,3S)-4-Acetyl-1-[4-(3,5-difluoro-benzyloxy)-ben...)Show SMILES C[C@H]1[C@@H](N(CCN1C(C)=O)S(=O)(=O)c1ccc(OCc2cc(F)cc(F)c2)cc1)C(=O)NO Show InChI InChI=1S/C21H23F2N3O6S/c1-13-20(21(28)24-29)26(8-7-25(13)14(2)27)33(30,31)19-5-3-18(4-6-19)32-12-15-9-16(22)11-17(23)10-15/h3-6,9-11,13,20,29H,7-8,12H2,1-2H3,(H,24,28)/t13-,20+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant tumor necrosis factor-alpha converting enzyme. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Disintegrin and metalloproteinase domain-containing protein 17
(Homo sapiens (Human)) | BDBM50132620
((2R,3S)-4-Acetyl-1-[4-(4-fluoro-benzyloxy)-benzene...)Show SMILES C[C@H]1[C@@H](N(CCN1C(C)=O)S(=O)(=O)c1ccc(OCc2ccc(F)cc2)cc1)C(=O)NO Show InChI InChI=1S/C21H24FN3O6S/c1-14-20(21(27)23-28)25(12-11-24(14)15(2)26)32(29,30)19-9-7-18(8-10-19)31-13-16-3-5-17(22)6-4-16/h3-10,14,20,28H,11-13H2,1-2H3,(H,23,27)/t14-,20+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant tumor necrosis factor-alpha converting enzyme. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50132621
((2S,3R)-3-Hydroxycarbamoyl-2-methyl-4-[4-(2-methyl...)Show SMILES CCOC(=O)N1CCN([C@H]([C@@H]1C)C(=O)NO)S(=O)(=O)c1ccc(OCc2ccccc2C)cc1 Show InChI InChI=1S/C23H29N3O7S/c1-4-32-23(28)25-13-14-26(21(17(25)3)22(27)24-29)34(30,31)20-11-9-19(10-12-20)33-15-18-8-6-5-7-16(18)2/h5-12,17,21,29H,4,13-15H2,1-3H3,(H,24,27)/t17-,21+/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
In vitro inhibition of matrix metalloprotease-13. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Disintegrin and metalloproteinase domain-containing protein 17
(Homo sapiens (Human)) | BDBM50132632
((2R,3S)-4-Acetyl-3-methyl-1-[4-(2-methyl-benzyloxy...)Show SMILES C[C@H]1[C@@H](N(CCN1C(C)=O)S(=O)(=O)c1ccc(OCc2ccccc2C)cc1)C(=O)NO Show InChI InChI=1S/C22H27N3O6S/c1-15-6-4-5-7-18(15)14-31-19-8-10-20(11-9-19)32(29,30)25-13-12-24(17(3)26)16(2)21(25)22(27)23-28/h4-11,16,21,28H,12-14H2,1-3H3,(H,23,27)/t16-,21+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant tumor necrosis factor-alpha converting enzyme. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Disintegrin and metalloproteinase domain-containing protein 17
(Homo sapiens (Human)) | BDBM50132628
((2R,3S)-4-Methanesulfonyl-3-methyl-1-[4-(2-methyl-...)Show SMILES C[C@H]1[C@@H](N(CCN1S(C)(=O)=O)S(=O)(=O)c1ccc(OCc2ccccc2C)cc1)C(=O)NO Show InChI InChI=1S/C21H27N3O7S2/c1-15-6-4-5-7-17(15)14-31-18-8-10-19(11-9-18)33(29,30)24-13-12-23(32(3,27)28)16(2)20(24)21(25)22-26/h4-11,16,20,26H,12-14H2,1-3H3,(H,22,25)/t16-,20+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant tumor necrosis factor-alpha converting enzyme. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50132623
((2R,3S)-4-Acetyl-1-[4-(5-fluoro-2-methyl-benzyloxy...)Show SMILES C[C@H]1[C@@H](N(CCN1C(C)=O)S(=O)(=O)c1ccc(OCc2cc(F)ccc2C)cc1)C(=O)NO Show InChI InChI=1S/C22H26FN3O6S/c1-14-4-5-18(23)12-17(14)13-32-19-6-8-20(9-7-19)33(30,31)26-11-10-25(16(3)27)15(2)21(26)22(28)24-29/h4-9,12,15,21,29H,10-11,13H2,1-3H3,(H,24,28)/t15-,21+/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
In vitro inhibition of matrix metalloprotease-13. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50089182
((2R,4S)-4-[4-(4-Fluoro-phenoxy)-phenyl]-5-oxo-pyrr...)Show SMILES ONC(=O)[C@H]1C[C@H](C(=O)N1)c1ccc(Oc2ccc(F)cc2)cc1 Show InChI InChI=1S/C17H15FN2O4/c18-11-3-7-13(8-4-11)24-12-5-1-10(2-6-12)14-9-15(17(22)20-23)19-16(14)21/h1-8,14-15,23H,9H2,(H,19,21)(H,20,22)/t14-,15+/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of Matrix metalloprotease-13 |
J Med Chem 43: 2293-6 (2000)
BindingDB Entry DOI: 10.7270/Q2930SDB |
More data for this
Ligand-Target Pair | |
Disintegrin and metalloproteinase domain-containing protein 17
(Homo sapiens (Human)) | BDBM50132623
((2R,3S)-4-Acetyl-1-[4-(5-fluoro-2-methyl-benzyloxy...)Show SMILES C[C@H]1[C@@H](N(CCN1C(C)=O)S(=O)(=O)c1ccc(OCc2cc(F)ccc2C)cc1)C(=O)NO Show InChI InChI=1S/C22H26FN3O6S/c1-14-4-5-18(23)12-17(14)13-32-19-6-8-20(9-7-19)33(30,31)26-11-10-25(16(3)27)15(2)21(26)22(28)24-29/h4-9,12,15,21,29H,10-11,13H2,1-3H3,(H,24,28)/t15-,21+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant tumor necrosis factor-alpha converting enzyme. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Disintegrin and metalloproteinase domain-containing protein 17
(Homo sapiens (Human)) | BDBM50132626
((2R,3S)-4-Acetyl-1-[4-(2-ethyl-benzyloxy)-benzenes...)Show SMILES CCc1ccccc1COc1ccc(cc1)S(=O)(=O)N1CCN([C@@H](C)[C@@H]1C(=O)NO)C(C)=O Show InChI InChI=1S/C23H29N3O6S/c1-4-18-7-5-6-8-19(18)15-32-20-9-11-21(12-10-20)33(30,31)26-14-13-25(17(3)27)16(2)22(26)23(28)24-29/h5-12,16,22,29H,4,13-15H2,1-3H3,(H,24,28)/t16-,22+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of Tumor necrosis factor-alpha (TNF-alpha) release in human whole blood |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50132624
((S)-3-(Formyl-hydroxy-amino)-2-isobutyl-4-methyl-p...)Show SMILES CC[C@H](C)[C@H](NC(=O)C(CC(C)C)[C@H](C(C)C)N(O)C=O)C(=O)Nc1ccccn1 Show InChI InChI=1S/C22H36N4O4/c1-7-16(6)19(22(29)24-18-10-8-9-11-23-18)25-21(28)17(12-14(2)3)20(15(4)5)26(30)13-27/h8-11,13-17,19-20,30H,7,12H2,1-6H3,(H,25,28)(H,23,24,29)/t16-,17?,19-,20-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
In vitro inhibition of matrix metalloprotease-13. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50089182
((2R,4S)-4-[4-(4-Fluoro-phenoxy)-phenyl]-5-oxo-pyrr...)Show SMILES ONC(=O)[C@H]1C[C@H](C(=O)N1)c1ccc(Oc2ccc(F)cc2)cc1 Show InChI InChI=1S/C17H15FN2O4/c18-11-3-7-13(8-4-11)24-12-5-1-10(2-6-12)14-9-15(17(22)20-23)19-16(14)21/h1-8,14-15,23H,9H2,(H,19,21)(H,20,22)/t14-,15+/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research & Development
Curated by ChEMBL
| Assay Description
Inhibition of Matrix metalloproteinase-13 |
Bioorg Med Chem Lett 11: 1211-3 (2001)
BindingDB Entry DOI: 10.7270/Q2BC3XTK |
More data for this
Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50132634
((2R,3S)-4-Acetyl-3-methyl-1-[4-(2-methyl-pyridin-3...)Show SMILES C[C@H]1[C@@H](N(CCN1C(C)=O)S(=O)(=O)c1ccc(OCc2cccnc2C)cc1)C(=O)NO Show InChI InChI=1S/C21H26N4O6S/c1-14-17(5-4-10-22-14)13-31-18-6-8-19(9-7-18)32(29,30)25-12-11-24(16(3)26)15(2)20(25)21(27)23-28/h4-10,15,20,28H,11-13H2,1-3H3,(H,23,27)/t15-,20+/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
In vitro inhibition of matrix metalloprotease-13. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Disintegrin and metalloproteinase domain-containing protein 17
(Homo sapiens (Human)) | BDBM50113038
((2R,4S)-1-(4-Benzyloxy-benzenesulfonyl)-4-hydroxy-...)Show SMILES ONC(=O)[C@H]1C[C@@H](O)CCN1S(=O)(=O)c1ccc(OCc2ccccc2)cc1 Show InChI InChI=1S/C19H22N2O6S/c22-15-10-11-21(18(12-15)19(23)20-24)28(25,26)17-8-6-16(7-9-17)27-13-14-4-2-1-3-5-14/h1-9,15,18,22,24H,10-13H2,(H,20,23)/t15-,18+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant tumor necrosis factor-alpha converting enzyme. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Disintegrin and metalloproteinase domain-containing protein 17
(Homo sapiens (Human)) | BDBM50132635
((2R,3S)-4-Acetyl-3-methyl-1-[4-(2-trifluoromethyl-...)Show SMILES C[C@H]1[C@@H](N(CCN1C(C)=O)S(=O)(=O)c1ccc(OCc2ccccc2C(F)(F)F)cc1)C(=O)NO Show InChI InChI=1S/C22H24F3N3O6S/c1-14-20(21(30)26-31)28(12-11-27(14)15(2)29)35(32,33)18-9-7-17(8-10-18)34-13-16-5-3-4-6-19(16)22(23,24)25/h3-10,14,20,31H,11-13H2,1-2H3,(H,26,30)/t14-,20+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of Tumor necrosis factor-alpha (TNF-alpha) release in human whole blood |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50132633
((2R,3S)-1-(4-Benzyloxy-benzenesulfonyl)-3-methyl-p...)Show SMILES C[C@@H]1NCCN([C@H]1C(=O)NO)S(=O)(=O)c1ccc(OCc2ccccc2)cc1 Show InChI InChI=1S/C19H23N3O5S/c1-14-18(19(23)21-24)22(12-11-20-14)28(25,26)17-9-7-16(8-10-17)27-13-15-5-3-2-4-6-15/h2-10,14,18,20,24H,11-13H2,1H3,(H,21,23)/t14-,18+/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
In vitro inhibition of matrix metalloprotease-13. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Disintegrin and metalloproteinase domain-containing protein 17
(Homo sapiens (Human)) | BDBM50111693
(5-Bromo-N-hydroxy-3-methyl-2-[methyl-(4-prop-2-yny...)Show SMILES CN(c1c(C)cc(Br)cc1C(=O)NO)S(=O)(=O)c1ccc(OCC#C)cc1 Show InChI InChI=1S/C18H17BrN2O5S/c1-4-9-26-14-5-7-15(8-6-14)27(24,25)21(3)17-12(2)10-13(19)11-16(17)18(22)20-23/h1,5-8,10-11,23H,9H2,2-3H3,(H,20,22) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant tumor necrosis factor-alpha converting enzyme. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Disintegrin and metalloproteinase domain-containing protein 17
(Homo sapiens (Human)) | BDBM50118975
(4-(4-Methoxy-benzenesulfonyl)-1-(thiophene-2-carbo...)Show SMILES COc1ccc(cc1)S(=O)(=O)N1Cc2ccccc2N(CC1C(=O)NO)C(=O)c1cccs1 Show InChI InChI=1S/C22H21N3O6S2/c1-31-16-8-10-17(11-9-16)33(29,30)25-13-15-5-2-3-6-18(15)24(14-19(25)21(26)23-28)22(27)20-7-4-12-32-20/h2-12,19,28H,13-14H2,1H3,(H,23,26) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant tumor necrosis factor-alpha converting enzyme. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Disintegrin and metalloproteinase domain-containing protein 17
(Homo sapiens (Human)) | BDBM50132625
((2S,3R)-3-Hydroxycarbamoyl-2-methyl-4-[4-(2-methyl...)Show SMILES COC(=O)N1CCN([C@H]([C@@H]1C)C(=O)NO)S(=O)(=O)c1ccc(OCc2ccccc2C)cc1 Show InChI InChI=1S/C22H27N3O7S/c1-15-6-4-5-7-17(15)14-32-18-8-10-19(11-9-18)33(29,30)25-13-12-24(22(27)31-3)16(2)20(25)21(26)23-28/h4-11,16,20,28H,12-14H2,1-3H3,(H,23,26)/t16-,20+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 14 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant tumor necrosis factor-alpha converting enzyme. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50132627
((2R,3S)-4-Acetyl-3-methyl-1-[4-(quinolin-4-ylmetho...)Show SMILES C[C@H]1[C@@H](N(CCN1C(C)=O)S(=O)(=O)c1ccc(OCc2ccnc3ccccc23)cc1)C(=O)NO Show InChI InChI=1S/C24H26N4O6S/c1-16-23(24(30)26-31)28(14-13-27(16)17(2)29)35(32,33)20-9-7-19(8-10-20)34-15-18-11-12-25-22-6-4-3-5-21(18)22/h3-12,16,23,31H,13-15H2,1-2H3,(H,26,30)/t16-,23+/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 17 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
In vitro inhibition of matrix metalloprotease-13. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50132624
((S)-3-(Formyl-hydroxy-amino)-2-isobutyl-4-methyl-p...)Show SMILES CC[C@H](C)[C@H](NC(=O)C(CC(C)C)[C@H](C(C)C)N(O)C=O)C(=O)Nc1ccccn1 Show InChI InChI=1S/C22H36N4O4/c1-7-16(6)19(22(29)24-18-10-8-9-11-23-18)25-21(28)17(12-14(2)3)20(15(4)5)26(30)13-27/h8-11,13-17,19-20,30H,7,12H2,1-6H3,(H,25,28)(H,23,24,29)/t16-,17?,19-,20-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 19 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
In vitro inhibition of matrix metalloprotease-1. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Disintegrin and metalloproteinase domain-containing protein 17
(Homo sapiens (Human)) | BDBM50132631
((2R,3S)-3-Methyl-1-[4-(2-methyl-benzyloxy)-benzene...)Show SMILES C[C@@H]1NCCN([C@H]1C(=O)NO)S(=O)(=O)c1ccc(OCc2ccccc2C)cc1 Show InChI InChI=1S/C20H25N3O5S/c1-14-5-3-4-6-16(14)13-28-17-7-9-18(10-8-17)29(26,27)23-12-11-21-15(2)19(23)20(24)22-25/h3-10,15,19,21,25H,11-13H2,1-2H3,(H,22,24)/t15-,19+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 19 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant tumor necrosis factor-alpha converting enzyme. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50132631
((2R,3S)-3-Methyl-1-[4-(2-methyl-benzyloxy)-benzene...)Show SMILES C[C@@H]1NCCN([C@H]1C(=O)NO)S(=O)(=O)c1ccc(OCc2ccccc2C)cc1 Show InChI InChI=1S/C20H25N3O5S/c1-14-5-3-4-6-16(14)13-28-17-7-9-18(10-8-17)29(26,27)23-12-11-21-15(2)19(23)20(24)22-25/h3-10,15,19,21,25H,11-13H2,1-2H3,(H,22,24)/t15-,19+/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 19 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
In vitro inhibition of matrix metalloprotease-13. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50132636
((2R,3S)-4-Acetyl-1-[4-(3,5-difluoro-benzyloxy)-ben...)Show SMILES C[C@H]1[C@@H](N(CCN1C(C)=O)S(=O)(=O)c1ccc(OCc2cc(F)cc(F)c2)cc1)C(=O)NO Show InChI InChI=1S/C21H23F2N3O6S/c1-13-20(21(28)24-29)26(8-7-25(13)14(2)27)33(30,31)19-5-3-18(4-6-19)32-12-15-9-16(22)11-17(23)10-15/h3-6,9-11,13,20,29H,7-8,12H2,1-2H3,(H,24,28)/t13-,20+/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
In vitro inhibition of matrix metalloprotease-13. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50118975
(4-(4-Methoxy-benzenesulfonyl)-1-(thiophene-2-carbo...)Show SMILES COc1ccc(cc1)S(=O)(=O)N1Cc2ccccc2N(CC1C(=O)NO)C(=O)c1cccs1 Show InChI InChI=1S/C22H21N3O6S2/c1-31-16-8-10-17(11-9-16)33(29,30)25-13-15-5-2-3-6-18(15)24(14-19(25)21(26)23-28)22(27)20-7-4-12-32-20/h2-12,19,28H,13-14H2,1H3,(H,23,26) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
In vitro inhibition of matrix metalloprotease-1. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Disintegrin and metalloproteinase domain-containing protein 17
(Homo sapiens (Human)) | BDBM50132633
((2R,3S)-1-(4-Benzyloxy-benzenesulfonyl)-3-methyl-p...)Show SMILES C[C@@H]1NCCN([C@H]1C(=O)NO)S(=O)(=O)c1ccc(OCc2ccccc2)cc1 Show InChI InChI=1S/C19H23N3O5S/c1-14-18(19(23)21-24)22(12-11-20-14)28(25,26)17-9-7-16(8-10-17)27-13-15-5-3-2-4-6-15/h2-10,14,18,20,24H,11-13H2,1H3,(H,21,23)/t14-,18+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 25 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of Tumor necrosis factor-alpha (TNF-alpha) release in human whole blood |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Disintegrin and metalloproteinase domain-containing protein 17
(Homo sapiens (Human)) | BDBM50132637
((2S,3R)-2-Methyl-4-[4-(2-methyl-benzyloxy)-benzene...)Show SMILES C[C@H]1[C@@H](N(CCN1C(=O)Nc1ccccc1)S(=O)(=O)c1ccc(OCc2ccccc2C)cc1)C(=O)NO Show InChI InChI=1S/C27H30N4O6S/c1-19-8-6-7-9-21(19)18-37-23-12-14-24(15-13-23)38(35,36)31-17-16-30(20(2)25(31)26(32)29-34)27(33)28-22-10-4-3-5-11-22/h3-15,20,25,34H,16-18H2,1-2H3,(H,28,33)(H,29,32)/t20-,25+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 26 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant tumor necrosis factor-alpha converting enzyme. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50099465
((R)-1-[4-(4-Fluoro-phenoxy)-benzyl]-2-oxo-imidazol...)Show SMILES ONC(=O)[C@H]1CN(Cc2ccc(Oc3ccc(F)cc3)cc2)C(=O)N1 Show InChI InChI=1S/C17H16FN3O4/c18-12-3-7-14(8-4-12)25-13-5-1-11(2-6-13)9-21-10-15(16(22)20-24)19-17(21)23/h1-8,15,24H,9-10H2,(H,19,23)(H,20,22)/t15-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 28 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research & Development
Curated by ChEMBL
| Assay Description
Inhibition of Matrix metalloproteinase-2 |
Bioorg Med Chem Lett 11: 1211-3 (2001)
BindingDB Entry DOI: 10.7270/Q2BC3XTK |
More data for this
Ligand-Target Pair | |
Disintegrin and metalloproteinase domain-containing protein 17
(Homo sapiens (Human)) | BDBM50132621
((2S,3R)-3-Hydroxycarbamoyl-2-methyl-4-[4-(2-methyl...)Show SMILES CCOC(=O)N1CCN([C@H]([C@@H]1C)C(=O)NO)S(=O)(=O)c1ccc(OCc2ccccc2C)cc1 Show InChI InChI=1S/C23H29N3O7S/c1-4-32-23(28)25-13-14-26(21(17(25)3)22(27)24-29)34(30,31)20-11-9-19(10-12-20)33-15-18-8-6-5-7-16(18)2/h5-12,17,21,29H,4,13-15H2,1-3H3,(H,24,27)/t17-,21+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 28 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant tumor necrosis factor-alpha converting enzyme. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Disintegrin and metalloproteinase domain-containing protein 17
(Homo sapiens (Human)) | BDBM50132630
((2R,3S)-3,4-Dimethyl-1-[4-(2-methyl-benzyloxy)-ben...)Show SMILES C[C@H]1[C@@H](N(CCN1C)S(=O)(=O)c1ccc(OCc2ccccc2C)cc1)C(=O)NO Show InChI InChI=1S/C21H27N3O5S/c1-15-6-4-5-7-17(15)14-29-18-8-10-19(11-9-18)30(27,28)24-13-12-23(3)16(2)20(24)21(25)22-26/h4-11,16,20,26H,12-14H2,1-3H3,(H,22,25)/t16-,20+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 31 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant tumor necrosis factor-alpha converting enzyme. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Disintegrin and metalloproteinase domain-containing protein 17
(Homo sapiens (Human)) | BDBM50132622
((2R,3S)-3-Methyl-1-[4-(2-methyl-benzyloxy)-benzene...)Show SMILES C[C@H]1[C@@H](N(CCN1S(=O)(=O)c1ccc(C)cc1)S(=O)(=O)c1ccc(OCc2ccccc2C)cc1)C(=O)NO Show InChI InChI=1S/C27H31N3O7S2/c1-19-8-12-24(13-9-19)38(33,34)29-16-17-30(26(21(29)3)27(31)28-32)39(35,36)25-14-10-23(11-15-25)37-18-22-7-5-4-6-20(22)2/h4-15,21,26,32H,16-18H2,1-3H3,(H,28,31)/t21-,26+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 32 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of Tumor necrosis factor-alpha (TNF-alpha) release in human whole blood |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Disintegrin and metalloproteinase domain-containing protein 17
(Homo sapiens (Human)) | BDBM50132638
((2S,3R)-2-Methyl-4-[4-(2-methyl-benzyloxy)-benzene...)Show SMILES CC(C)NC(=O)N1CCN([C@H]([C@@H]1C)C(=O)NO)S(=O)(=O)c1ccc(OCc2ccccc2C)cc1 Show InChI InChI=1S/C24H32N4O6S/c1-16(2)25-24(30)27-13-14-28(22(18(27)4)23(29)26-31)35(32,33)21-11-9-20(10-12-21)34-15-19-8-6-5-7-17(19)3/h5-12,16,18,22,31H,13-15H2,1-4H3,(H,25,30)(H,26,29)/t18-,22+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 34 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant tumor necrosis factor-alpha converting enzyme. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50089182
((2R,4S)-4-[4-(4-Fluoro-phenoxy)-phenyl]-5-oxo-pyrr...)Show SMILES ONC(=O)[C@H]1C[C@H](C(=O)N1)c1ccc(Oc2ccc(F)cc2)cc1 Show InChI InChI=1S/C17H15FN2O4/c18-11-3-7-13(8-4-11)24-12-5-1-10(2-6-12)14-9-15(17(22)20-23)19-16(14)21/h1-8,14-15,23H,9H2,(H,19,21)(H,20,22)/t14-,15+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 39 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Inhibition of matrix metalloprotease -2 |
J Med Chem 43: 2293-6 (2000)
BindingDB Entry DOI: 10.7270/Q2930SDB |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50089182
((2R,4S)-4-[4-(4-Fluoro-phenoxy)-phenyl]-5-oxo-pyrr...)Show SMILES ONC(=O)[C@H]1C[C@H](C(=O)N1)c1ccc(Oc2ccc(F)cc2)cc1 Show InChI InChI=1S/C17H15FN2O4/c18-11-3-7-13(8-4-11)24-12-5-1-10(2-6-12)14-9-15(17(22)20-23)19-16(14)21/h1-8,14-15,23H,9H2,(H,19,21)(H,20,22)/t14-,15+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 39 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research & Development
Curated by ChEMBL
| Assay Description
Inhibition of Matrix metalloproteinase-2 |
Bioorg Med Chem Lett 11: 1211-3 (2001)
BindingDB Entry DOI: 10.7270/Q2BC3XTK |
More data for this
Ligand-Target Pair | |
Disintegrin and metalloproteinase domain-containing protein 17
(Homo sapiens (Human)) | BDBM50132624
((S)-3-(Formyl-hydroxy-amino)-2-isobutyl-4-methyl-p...)Show SMILES CC[C@H](C)[C@H](NC(=O)C(CC(C)C)[C@H](C(C)C)N(O)C=O)C(=O)Nc1ccccn1 Show InChI InChI=1S/C22H36N4O4/c1-7-16(6)19(22(29)24-18-10-8-9-11-23-18)25-21(28)17(12-14(2)3)20(15(4)5)26(30)13-27/h8-11,13-17,19-20,30H,7,12H2,1-6H3,(H,25,28)(H,23,24,29)/t16-,17?,19-,20-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant tumor necrosis factor-alpha converting enzyme. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50132626
((2R,3S)-4-Acetyl-1-[4-(2-ethyl-benzyloxy)-benzenes...)Show SMILES CCc1ccccc1COc1ccc(cc1)S(=O)(=O)N1CCN([C@@H](C)[C@@H]1C(=O)NO)C(C)=O Show InChI InChI=1S/C23H29N3O6S/c1-4-18-7-5-6-8-19(18)15-32-20-9-11-21(12-10-20)33(30,31)26-14-13-25(17(3)27)16(2)22(26)23(28)24-29/h5-12,16,22,29H,4,13-15H2,1-3H3,(H,24,28)/t16-,22+/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
In vitro inhibition of matrix metalloprotease-13. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50111693
(5-Bromo-N-hydroxy-3-methyl-2-[methyl-(4-prop-2-yny...)Show SMILES CN(c1c(C)cc(Br)cc1C(=O)NO)S(=O)(=O)c1ccc(OCC#C)cc1 Show InChI InChI=1S/C18H17BrN2O5S/c1-4-9-26-14-5-7-15(8-6-14)27(24,25)21(3)17-12(2)10-13(19)11-16(17)18(22)20-23/h1,5-8,10-11,23H,9H2,2-3H3,(H,20,22) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 52 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
In vitro inhibition of matrix metalloprotease-1. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50099466
((R)-1-[4-(Naphthalen-2-yloxy)-benzyl]-2-oxo-imidaz...)Show SMILES ONC(=O)[C@H]1CN(Cc2ccc(Oc3ccc4ccccc4c3)cc2)C(=O)N1 Show InChI InChI=1S/C21H19N3O4/c25-20(23-27)19-13-24(21(26)22-19)12-14-5-8-17(9-6-14)28-18-10-7-15-3-1-2-4-16(15)11-18/h1-11,19,27H,12-13H2,(H,22,26)(H,23,25)/t19-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 56 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research & Development
Curated by ChEMBL
| Assay Description
Inhibition of Matrix metalloproteinase-9 |
Bioorg Med Chem Lett 11: 1211-3 (2001)
BindingDB Entry DOI: 10.7270/Q2BC3XTK |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50099466
((R)-1-[4-(Naphthalen-2-yloxy)-benzyl]-2-oxo-imidaz...)Show SMILES ONC(=O)[C@H]1CN(Cc2ccc(Oc3ccc4ccccc4c3)cc2)C(=O)N1 Show InChI InChI=1S/C21H19N3O4/c25-20(23-27)19-13-24(21(26)22-19)12-14-5-8-17(9-6-14)28-18-10-7-15-3-1-2-4-16(15)11-18/h1-11,19,27H,12-13H2,(H,22,26)(H,23,25)/t19-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 59 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research & Development
Curated by ChEMBL
| Assay Description
Inhibition of Matrix metalloproteinase-2 |
Bioorg Med Chem Lett 11: 1211-3 (2001)
BindingDB Entry DOI: 10.7270/Q2BC3XTK |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50099465
((R)-1-[4-(4-Fluoro-phenoxy)-benzyl]-2-oxo-imidazol...)Show SMILES ONC(=O)[C@H]1CN(Cc2ccc(Oc3ccc(F)cc3)cc2)C(=O)N1 Show InChI InChI=1S/C17H16FN3O4/c18-12-3-7-14(8-4-12)25-13-5-1-11(2-6-13)9-21-10-15(16(22)20-24)19-17(21)23/h1-8,15,24H,9-10H2,(H,19,23)(H,20,22)/t15-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 62 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research & Development
Curated by ChEMBL
| Assay Description
Inhibition of Matrix metalloproteinase-9 |
Bioorg Med Chem Lett 11: 1211-3 (2001)
BindingDB Entry DOI: 10.7270/Q2BC3XTK |
More data for this
Ligand-Target Pair | |
Disintegrin and metalloproteinase domain-containing protein 17
(Homo sapiens (Human)) | BDBM50132619
((2R,3S)-4-Benzyl-3-methyl-1-[4-(2-methyl-benzyloxy...)Show SMILES C[C@H]1[C@@H](N(CCN1Cc1ccccc1)S(=O)(=O)c1ccc(OCc2ccccc2C)cc1)C(=O)NO Show InChI InChI=1S/C27H31N3O5S/c1-20-8-6-7-11-23(20)19-35-24-12-14-25(15-13-24)36(33,34)30-17-16-29(18-22-9-4-3-5-10-22)21(2)26(30)27(31)28-32/h3-15,21,26,32H,16-19H2,1-2H3,(H,28,31)/t21-,26+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 68 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research and Development
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant tumor necrosis factor-alpha converting enzyme. |
Bioorg Med Chem Lett 13: 3243-6 (2003)
BindingDB Entry DOI: 10.7270/Q2Q23ZMM |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50089182
((2R,4S)-4-[4-(4-Fluoro-phenoxy)-phenyl]-5-oxo-pyrr...)Show SMILES ONC(=O)[C@H]1C[C@H](C(=O)N1)c1ccc(Oc2ccc(F)cc2)cc1 Show InChI InChI=1S/C17H15FN2O4/c18-11-3-7-13(8-4-11)24-12-5-1-10(2-6-12)14-9-15(17(22)20-23)19-16(14)21/h1-8,14-15,23H,9H2,(H,19,21)(H,20,22)/t14-,15+/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 82 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Global Research & Development
Curated by ChEMBL
| Assay Description
Inhibition of Matrix metalloproteinase-9 |
Bioorg Med Chem Lett 11: 1211-3 (2001)
BindingDB Entry DOI: 10.7270/Q2BC3XTK |
More data for this
Ligand-Target Pair | |
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