Found 186 hits with Last Name = 'narensingh' and Initial = 'r' 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 |
|---|
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50090364
(3-[2-Hydroxycarbamoyl-1-(4-methoxy-benzenesulfonyl...)Show SMILES CCOC(=O)C1CCCC(C1)C(CC(=O)NO)S(=O)(=O)c1ccc(OC)cc1 Show InChI InChI=1S/C19H27NO7S/c1-3-27-19(22)14-6-4-5-13(11-14)17(12-18(21)20-23)28(24,25)16-9-7-15(26-2)8-10-16/h7-10,13-14,17,23H,3-6,11-12H2,1-2H3,(H,20,21) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 0.800 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-2. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50090350
(4-Ethyl-3-(4-methoxy-benzenesulfonyl)-octanoic aci...)Show InChI InChI=1S/C17H27NO5S/c1-4-6-7-13(5-2)16(12-17(19)18-20)24(21,22)15-10-8-14(23-3)9-11-15/h8-11,13,16,20H,4-7,12H2,1-3H3,(H,18,19) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-2. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50090347
(3-Cyclohexyl-N-hydroxy-3-(4-methoxy-benzenesulfony...)Show InChI InChI=1S/C16H23NO5S/c1-22-13-7-9-14(10-8-13)23(20,21)15(11-16(18)17-19)12-5-3-2-4-6-12/h7-10,12,15,19H,2-6,11H2,1H3,(H,17,18) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 8 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-2. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50090372
(3-(4-Methoxy-benzenesulfonyl)-4-phenyl-pentanoic a...)Show SMILES COc1ccc(cc1)S(=O)(=O)C(CC(=O)NO)C(C)c1ccccc1 Show InChI InChI=1S/C18H21NO5S/c1-13(14-6-4-3-5-7-14)17(12-18(20)19-21)25(22,23)16-10-8-15(24-2)9-11-16/h3-11,13,17,21H,12H2,1-2H3,(H,19,20) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| 8 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-2. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50074027
(3-(4-Methoxy-benzenesulfonyl)-7-phenyl-heptanoic a...)Show SMILES COc1ccc(cc1)S(=O)(=O)C(CCCCc1ccccc1)CC(=O)NO Show InChI InChI=1S/C20H25NO5S/c1-26-17-11-13-18(14-12-17)27(24,25)19(15-20(22)21-23)10-6-5-9-16-7-3-2-4-8-16/h2-4,7-8,11-14,19,23H,5-6,9-10,15H2,1H3,(H,21,22) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| 20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-2. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50090377
(3-(4-Methoxy-benzenesulfonyl)-5,7,7-trimethyl-octa...)Show SMILES COc1ccc(cc1)S(=O)(=O)C(CC(C)CC(C)(C)C)CC(=O)NO Show InChI InChI=1S/C18H29NO5S/c1-13(12-18(2,3)4)10-16(11-17(20)19-21)25(22,23)15-8-6-14(24-5)7-9-15/h6-9,13,16,21H,10-12H2,1-5H3,(H,19,20) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 27 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-2. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50089209
(3-(4-Methoxy-benzenesulfonyl)-heptanoic acid hydro...)Show InChI InChI=1S/C14H21NO5S/c1-3-4-5-13(10-14(16)15-17)21(18,19)12-8-6-11(20-2)7-9-12/h6-9,13,17H,3-5,10H2,1-2H3,(H,15,16) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-2. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50090366
(3-(4-Methoxy-benzenesulfonyl)-nonanoic acid hydrox...)Show InChI InChI=1S/C16H25NO5S/c1-3-4-5-6-7-15(12-16(18)17-19)23(20,21)14-10-8-13(22-2)9-11-14/h8-11,15,19H,3-7,12H2,1-2H3,(H,17,18) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 31 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-2. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50090357
(5-Cyclohexyl-3-(4-methoxy-benzenesulfonyl)-pentano...)Show InChI InChI=1S/C18H27NO5S/c1-24-15-8-11-16(12-9-15)25(22,23)17(13-18(20)19-21)10-7-14-5-3-2-4-6-14/h8-9,11-12,14,17,21H,2-7,10,13H2,1H3,(H,19,20) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 36 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-2. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50090382
(4-Benzyloxy-N-hydroxy-3-(4-methoxy-benzenesulfonyl...)Show SMILES COc1ccc(cc1)S(=O)(=O)C(COCc1ccccc1)CC(=O)NO Show InChI InChI=1S/C18H21NO6S/c1-24-15-7-9-16(10-8-15)26(22,23)17(11-18(20)19-21)13-25-12-14-5-3-2-4-6-14/h2-10,17,21H,11-13H2,1H3,(H,19,20) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| PubMed
| 38 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-2. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50074021
(3-(4-Methoxy-benzenesulfonyl)-5-phenyl-pentanoic a...)Show InChI InChI=1S/C18H21NO5S/c1-24-15-8-11-16(12-9-15)25(22,23)17(13-18(20)19-21)10-7-14-5-3-2-4-6-14/h2-6,8-9,11-12,17,21H,7,10,13H2,1H3,(H,19,20) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| 43 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-2. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50074028
(3-(4-Methoxy-benzenesulfonyl)-6-phenyl-hexanoic ac...)Show SMILES COc1ccc(cc1)S(=O)(=O)C(CCCc1ccccc1)CC(=O)NO Show InChI InChI=1S/C19H23NO5S/c1-25-16-10-12-17(13-11-16)26(23,24)18(14-19(21)20-22)9-5-8-15-6-3-2-4-7-15/h2-4,6-7,10-13,18,22H,5,8-9,14H2,1H3,(H,20,21) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 44 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-2. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Stromelysin-1
(Homo sapiens (Human)) | BDBM50090364
(3-[2-Hydroxycarbamoyl-1-(4-methoxy-benzenesulfonyl...)Show SMILES CCOC(=O)C1CCCC(C1)C(CC(=O)NO)S(=O)(=O)c1ccc(OC)cc1 Show InChI InChI=1S/C19H27NO7S/c1-3-27-19(22)14-6-4-5-13(11-14)17(12-18(21)20-23)28(24,25)16-9-7-15(26-2)8-10-16/h7-10,13-14,17,23H,3-6,11-12H2,1-2H3,(H,20,21) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-3. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Stromelysin-1
(Homo sapiens (Human)) | BDBM50090347
(3-Cyclohexyl-N-hydroxy-3-(4-methoxy-benzenesulfony...)Show InChI InChI=1S/C16H23NO5S/c1-22-13-7-9-14(10-8-13)23(20,21)15(11-16(18)17-19)12-5-3-2-4-6-12/h7-10,12,15,19H,2-6,11H2,1H3,(H,17,18) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 86 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-3. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50090370
(4-[2-Hydroxycarbamoyl-1-(4-methoxy-benzenesulfonyl...)Show SMILES COC(=O)c1ccc(cc1)C(CC(=O)NO)S(=O)(=O)c1ccc(OC)cc1 Show InChI InChI=1S/C18H19NO7S/c1-25-14-7-9-15(10-8-14)27(23,24)16(11-17(20)19-22)12-3-5-13(6-4-12)18(21)26-2/h3-10,16,22H,11H2,1-2H3,(H,19,20) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 88 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-2. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Stromelysin-1
(Homo sapiens (Human)) | BDBM50090350
(4-Ethyl-3-(4-methoxy-benzenesulfonyl)-octanoic aci...)Show InChI InChI=1S/C17H27NO5S/c1-4-6-7-13(5-2)16(12-17(19)18-20)24(21,22)15-10-8-14(23-3)9-11-15/h8-11,13,16,20H,4-7,12H2,1-3H3,(H,18,19) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 184 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-3. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50090343
(CHEMBL42537 | N-Hydroxy-3-(4-methoxy-benzenesulfon...)Show InChI InChI=1S/C16H17NO5S/c1-22-13-7-9-14(10-8-13)23(20,21)15(11-16(18)17-19)12-5-3-2-4-6-12/h2-10,15,19H,11H2,1H3,(H,17,18) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| 270 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-2. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Stromelysin-1
(Homo sapiens (Human)) | BDBM50090372
(3-(4-Methoxy-benzenesulfonyl)-4-phenyl-pentanoic a...)Show SMILES COc1ccc(cc1)S(=O)(=O)C(CC(=O)NO)C(C)c1ccccc1 Show InChI InChI=1S/C18H21NO5S/c1-13(14-6-4-3-5-7-14)17(12-18(20)19-21)25(22,23)16-10-8-15(24-2)9-11-16/h3-11,13,17,21H,12H2,1-2H3,(H,19,20) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| 300 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-3. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Stromelysin-1
(Homo sapiens (Human)) | BDBM50074021
(3-(4-Methoxy-benzenesulfonyl)-5-phenyl-pentanoic a...)Show InChI InChI=1S/C18H21NO5S/c1-24-15-8-11-16(12-9-15)25(22,23)17(13-18(20)19-21)10-7-14-5-3-2-4-6-14/h2-6,8-9,11-12,17,21H,7,10,13H2,1H3,(H,19,20) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| 350 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-3. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50090350
(4-Ethyl-3-(4-methoxy-benzenesulfonyl)-octanoic aci...)Show InChI InChI=1S/C17H27NO5S/c1-4-6-7-13(5-2)16(12-17(19)18-20)24(21,22)15-10-8-14(23-3)9-11-15/h8-11,13,16,20H,4-7,12H2,1-3H3,(H,18,19) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 357 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-1. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50090357
(5-Cyclohexyl-3-(4-methoxy-benzenesulfonyl)-pentano...)Show InChI InChI=1S/C18H27NO5S/c1-24-15-8-11-16(12-9-15)25(22,23)17(13-18(20)19-21)10-7-14-5-3-2-4-6-14/h8-9,11-12,14,17,21H,2-7,10,13H2,1H3,(H,19,20) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 400 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-1. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Stromelysin-1
(Homo sapiens (Human)) | BDBM50089209
(3-(4-Methoxy-benzenesulfonyl)-heptanoic acid hydro...)Show InChI InChI=1S/C14H21NO5S/c1-3-4-5-13(10-14(16)15-17)21(18,19)12-8-6-11(20-2)7-9-12/h6-9,13,17H,3-5,10H2,1-2H3,(H,15,16) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 404 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-3. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Stromelysin-1
(Homo sapiens (Human)) | BDBM50090357
(5-Cyclohexyl-3-(4-methoxy-benzenesulfonyl)-pentano...)Show InChI InChI=1S/C18H27NO5S/c1-24-15-8-11-16(12-9-15)25(22,23)17(13-18(20)19-21)10-7-14-5-3-2-4-6-14/h8-9,11-12,14,17,21H,2-7,10,13H2,1H3,(H,19,20) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 590 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-3. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Stromelysin-1
(Homo sapiens (Human)) | BDBM50090377
(3-(4-Methoxy-benzenesulfonyl)-5,7,7-trimethyl-octa...)Show SMILES COc1ccc(cc1)S(=O)(=O)C(CC(C)CC(C)(C)C)CC(=O)NO Show InChI InChI=1S/C18H29NO5S/c1-13(12-18(2,3)4)10-16(11-17(20)19-21)25(22,23)15-8-6-14(24-5)7-9-15/h6-9,13,16,21H,10-12H2,1-5H3,(H,19,20) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 676 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-3. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Stromelysin-1
(Homo sapiens (Human)) | BDBM50074027
(3-(4-Methoxy-benzenesulfonyl)-7-phenyl-heptanoic a...)Show SMILES COc1ccc(cc1)S(=O)(=O)C(CCCCc1ccccc1)CC(=O)NO Show InChI InChI=1S/C20H25NO5S/c1-26-17-11-13-18(14-12-17)27(24,25)19(15-20(22)21-23)10-6-5-9-16-7-3-2-4-8-16/h2-4,7-8,11-14,19,23H,5-6,9-10,15H2,1H3,(H,21,22) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| 700 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-3. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Stromelysin-1
(Homo sapiens (Human)) | BDBM50090366
(3-(4-Methoxy-benzenesulfonyl)-nonanoic acid hydrox...)Show InChI InChI=1S/C16H25NO5S/c1-3-4-5-6-7-15(12-16(18)17-19)23(20,21)14-10-8-13(22-2)9-11-14/h8-11,15,19H,3-7,12H2,1-2H3,(H,17,18) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 734 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-3. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50090364
(3-[2-Hydroxycarbamoyl-1-(4-methoxy-benzenesulfonyl...)Show SMILES CCOC(=O)C1CCCC(C1)C(CC(=O)NO)S(=O)(=O)c1ccc(OC)cc1 Show InChI InChI=1S/C19H27NO7S/c1-3-27-19(22)14-6-4-5-13(11-14)17(12-18(21)20-23)28(24,25)16-9-7-15(26-2)8-10-16/h7-10,13-14,17,23H,3-6,11-12H2,1-2H3,(H,20,21) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 1.01E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-1. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Stromelysin-1
(Homo sapiens (Human)) | BDBM50074028
(3-(4-Methoxy-benzenesulfonyl)-6-phenyl-hexanoic ac...)Show SMILES COc1ccc(cc1)S(=O)(=O)C(CCCc1ccccc1)CC(=O)NO Show InChI InChI=1S/C19H23NO5S/c1-25-16-10-12-17(13-11-16)26(23,24)18(14-19(21)20-22)9-5-8-15-6-3-2-4-7-15/h2-4,6-7,10-13,18,22H,5,8-9,14H2,1H3,(H,20,21) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 1.39E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-3. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Stromelysin-1
(Homo sapiens (Human)) | BDBM50090382
(4-Benzyloxy-N-hydroxy-3-(4-methoxy-benzenesulfonyl...)Show SMILES COc1ccc(cc1)S(=O)(=O)C(COCc1ccccc1)CC(=O)NO Show InChI InChI=1S/C18H21NO6S/c1-24-15-7-9-16(10-8-15)26(22,23)17(11-18(20)19-21)13-25-12-14-5-3-2-4-6-14/h2-10,17,21H,11-13H2,1H3,(H,19,20) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| PubMed
| 1.43E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-3. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50090372
(3-(4-Methoxy-benzenesulfonyl)-4-phenyl-pentanoic a...)Show SMILES COc1ccc(cc1)S(=O)(=O)C(CC(=O)NO)C(C)c1ccccc1 Show InChI InChI=1S/C18H21NO5S/c1-13(14-6-4-3-5-7-14)17(12-18(20)19-21)25(22,23)16-10-8-15(24-2)9-11-16/h3-11,13,17,21H,12H2,1-2H3,(H,19,20) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| 1.71E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-1. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50090347
(3-Cyclohexyl-N-hydroxy-3-(4-methoxy-benzenesulfony...)Show InChI InChI=1S/C16H23NO5S/c1-22-13-7-9-14(10-8-13)23(20,21)15(11-16(18)17-19)12-5-3-2-4-6-12/h7-10,12,15,19H,2-6,11H2,1H3,(H,17,18) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 1.71E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-1. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50090377
(3-(4-Methoxy-benzenesulfonyl)-5,7,7-trimethyl-octa...)Show SMILES COc1ccc(cc1)S(=O)(=O)C(CC(C)CC(C)(C)C)CC(=O)NO Show InChI InChI=1S/C18H29NO5S/c1-13(12-18(2,3)4)10-16(11-17(20)19-21)25(22,23)15-8-6-14(24-5)7-9-15/h6-9,13,16,21H,10-12H2,1-5H3,(H,19,20) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 1.72E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-1. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50090370
(4-[2-Hydroxycarbamoyl-1-(4-methoxy-benzenesulfonyl...)Show SMILES COC(=O)c1ccc(cc1)C(CC(=O)NO)S(=O)(=O)c1ccc(OC)cc1 Show InChI InChI=1S/C18H19NO7S/c1-25-14-7-9-15(10-8-14)27(23,24)16(11-17(20)19-22)12-3-5-13(6-4-12)18(21)26-2/h3-10,16,22H,11H2,1-2H3,(H,19,20) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 1.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-1. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50074021
(3-(4-Methoxy-benzenesulfonyl)-5-phenyl-pentanoic a...)Show InChI InChI=1S/C18H21NO5S/c1-24-15-8-11-16(12-9-15)25(22,23)17(13-18(20)19-21)10-7-14-5-3-2-4-6-14/h2-6,8-9,11-12,17,21H,7,10,13H2,1H3,(H,19,20) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| 2.16E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-1. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50074028
(3-(4-Methoxy-benzenesulfonyl)-6-phenyl-hexanoic ac...)Show SMILES COc1ccc(cc1)S(=O)(=O)C(CCCc1ccccc1)CC(=O)NO Show InChI InChI=1S/C19H23NO5S/c1-25-16-10-12-17(13-11-16)26(23,24)18(14-19(21)20-22)9-5-8-15-6-3-2-4-7-15/h2-4,6-7,10-13,18,22H,5,8-9,14H2,1H3,(H,20,21) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 2.58E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-1. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Stromelysin-1
(Homo sapiens (Human)) | BDBM50090343
(CHEMBL42537 | N-Hydroxy-3-(4-methoxy-benzenesulfon...)Show InChI InChI=1S/C16H17NO5S/c1-22-13-7-9-14(10-8-13)23(20,21)15(11-16(18)17-19)12-5-3-2-4-6-12/h2-10,15,19H,11H2,1H3,(H,17,18) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| 3.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-3. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50089209
(3-(4-Methoxy-benzenesulfonyl)-heptanoic acid hydro...)Show InChI InChI=1S/C14H21NO5S/c1-3-4-5-13(10-14(16)15-17)21(18,19)12-8-6-11(20-2)7-9-12/h6-9,13,17H,3-5,10H2,1-2H3,(H,15,16) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 4.17E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-1. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Stromelysin-1
(Homo sapiens (Human)) | BDBM50090370
(4-[2-Hydroxycarbamoyl-1-(4-methoxy-benzenesulfonyl...)Show SMILES COC(=O)c1ccc(cc1)C(CC(=O)NO)S(=O)(=O)c1ccc(OC)cc1 Show InChI InChI=1S/C18H19NO7S/c1-25-14-7-9-15(10-8-14)27(23,24)16(11-17(20)19-22)12-3-5-13(6-4-12)18(21)26-2/h3-10,16,22H,11H2,1-2H3,(H,19,20) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 4.42E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-3. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50074027
(3-(4-Methoxy-benzenesulfonyl)-7-phenyl-heptanoic a...)Show SMILES COc1ccc(cc1)S(=O)(=O)C(CCCCc1ccccc1)CC(=O)NO Show InChI InChI=1S/C20H25NO5S/c1-26-17-11-13-18(14-12-17)27(24,25)19(15-20(22)21-23)10-6-5-9-16-7-3-2-4-8-16/h2-4,7-8,11-14,19,23H,5-6,9-10,15H2,1H3,(H,21,22) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| 5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-1. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50090366
(3-(4-Methoxy-benzenesulfonyl)-nonanoic acid hydrox...)Show InChI InChI=1S/C16H25NO5S/c1-3-4-5-6-7-15(12-16(18)17-19)23(20,21)14-10-8-13(22-2)9-11-14/h8-11,15,19H,3-7,12H2,1-2H3,(H,17,18) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 9.59E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-1. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50090374
(CHEMBL43050 | N-Hydroxy-3-(4-methoxy-benzenesulfon...)Show SMILES COc1ccc(cc1)S(=O)(=O)C(CC(=O)NO)c1ccc(Oc2ccccc2)cc1 Show InChI InChI=1S/C22H21NO6S/c1-28-17-11-13-20(14-12-17)30(26,27)21(15-22(24)23-25)16-7-9-19(10-8-16)29-18-5-3-2-4-6-18/h2-14,21,25H,15H2,1H3,(H,23,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-1. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Stromelysin-1
(Homo sapiens (Human)) | BDBM50090374
(CHEMBL43050 | N-Hydroxy-3-(4-methoxy-benzenesulfon...)Show SMILES COc1ccc(cc1)S(=O)(=O)C(CC(=O)NO)c1ccc(Oc2ccccc2)cc1 Show InChI InChI=1S/C22H21NO6S/c1-28-17-11-13-20(14-12-17)30(26,27)21(15-22(24)23-25)16-7-9-19(10-8-16)29-18-5-3-2-4-6-18/h2-14,21,25H,15H2,1H3,(H,23,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-3. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50090344
(CHEMBL45035 | N-Hydroxy-3-(4-isopropoxy-phenyl)-3-...)Show SMILES COc1ccc(cc1)S(=O)(=O)C(CC(=O)NO)c1ccc(OC(C)C)cc1 Show InChI InChI=1S/C19H23NO6S/c1-13(2)26-16-6-4-14(5-7-16)18(12-19(21)20-22)27(23,24)17-10-8-15(25-3)9-11-17/h4-11,13,18,22H,12H2,1-3H3,(H,20,21) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-2. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Stromelysin-1
(Homo sapiens (Human)) | BDBM50090358
(3-Biphenyl-4-yl-N-hydroxy-3-(4-methoxy-benzenesulf...)Show SMILES COc1ccc(cc1)S(=O)(=O)C(CC(=O)NO)c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C22H21NO5S/c1-28-19-11-13-20(14-12-19)29(26,27)21(15-22(24)23-25)18-9-7-17(8-10-18)16-5-3-2-4-6-16/h2-14,21,25H,15H2,1H3,(H,23,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-3. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50090358
(3-Biphenyl-4-yl-N-hydroxy-3-(4-methoxy-benzenesulf...)Show SMILES COc1ccc(cc1)S(=O)(=O)C(CC(=O)NO)c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C22H21NO5S/c1-28-19-11-13-20(14-12-19)29(26,27)21(15-22(24)23-25)18-9-7-17(8-10-18)16-5-3-2-4-6-16/h2-14,21,25H,15H2,1H3,(H,23,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-1. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50090382
(4-Benzyloxy-N-hydroxy-3-(4-methoxy-benzenesulfonyl...)Show SMILES COc1ccc(cc1)S(=O)(=O)C(COCc1ccccc1)CC(=O)NO Show InChI InChI=1S/C18H21NO6S/c1-24-15-7-9-16(10-8-15)26(22,23)17(11-18(20)19-21)13-25-12-14-5-3-2-4-6-14/h2-10,17,21H,11-13H2,1H3,(H,19,20) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-1. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50090343
(CHEMBL42537 | N-Hydroxy-3-(4-methoxy-benzenesulfon...)Show InChI InChI=1S/C16H17NO5S/c1-22-13-7-9-14(10-8-13)23(20,21)15(11-16(18)17-19)12-5-3-2-4-6-12/h2-10,15,19H,11H2,1H3,(H,17,18) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-1. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50090374
(CHEMBL43050 | N-Hydroxy-3-(4-methoxy-benzenesulfon...)Show SMILES COc1ccc(cc1)S(=O)(=O)C(CC(=O)NO)c1ccc(Oc2ccccc2)cc1 Show InChI InChI=1S/C22H21NO6S/c1-28-17-11-13-20(14-12-17)30(26,27)21(15-22(24)23-25)16-7-9-19(10-8-16)29-18-5-3-2-4-6-18/h2-14,21,25H,15H2,1H3,(H,23,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-2. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50090368
(3-(4-Benzyloxy-phenyl)-N-hydroxy-3-(4-methoxy-benz...)Show SMILES COc1ccc(cc1)S(=O)(=O)C(CC(=O)NO)c1ccc(OCc2ccccc2)cc1 Show InChI InChI=1S/C23H23NO6S/c1-29-19-11-13-21(14-12-19)31(27,28)22(15-23(25)24-26)18-7-9-20(10-8-18)30-16-17-5-3-2-4-6-17/h2-14,22,26H,15-16H2,1H3,(H,24,25) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-1. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50090344
(CHEMBL45035 | N-Hydroxy-3-(4-isopropoxy-phenyl)-3-...)Show SMILES COc1ccc(cc1)S(=O)(=O)C(CC(=O)NO)c1ccc(OC(C)C)cc1 Show InChI InChI=1S/C19H23NO6S/c1-13(2)26-16-6-4-14(5-7-16)18(12-19(21)20-22)27(23,24)17-10-8-15(25-3)9-11-17/h4-11,13,18,22H,12H2,1-3H3,(H,20,21) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Rhone Poulenc Rorer
Curated by ChEMBL
| Assay Description
In vitro inhibition of human recombinant Matrix metalloproteinase-1. |
Bioorg Med Chem Lett 10: 1637-40 (2000)
BindingDB Entry DOI: 10.7270/Q20G3JDK |
More data for this
Ligand-Target Pair | |
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