Found 42 hits of Enzyme Inhibition Constant Data 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 |
|---|
Stromelysin-1
(Homo sapiens (Human)) | BDBM50073839
(CHEMBL283066 | [4-(1,3-Dioxo-1,3-dihydro-isoindol-...)Show SMILES CC(C)C[C@@H](NC(=O)[C@H](CCc1ccccc1)CP(O)(=O)CCCCN1C(=O)c2ccccc2C1=O)C(=O)Nc1ccccc1 Show InChI InChI=1S/C35H42N3O6P/c1-25(2)23-31(33(40)36-28-15-7-4-8-16-28)37-32(39)27(20-19-26-13-5-3-6-14-26)24-45(43,44)22-12-11-21-38-34(41)29-17-9-10-18-30(29)35(38)42/h3-10,13-18,25,27,31H,11-12,19-24H2,1-2H3,(H,36,40)(H,37,39)(H,43,44)/t27-,31-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 1.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibition of recombinant matrix metalloprotease-3 (MMP-3) |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50073823
(CHEMBL24871 | {4-[((S)-1-Acetyl-pyrrolidine-2-carb...)Show SMILES CC(C)C[C@@H](NC(=O)[C@H](CCc1ccccc1)CP(O)(=O)CCCCNC(=O)[C@@H]1CCCN1C(C)=O)C(=O)Nc1ccccc1 Show InChI InChI=1S/C34H49N4O6P/c1-25(2)23-30(33(41)36-29-15-8-5-9-16-29)37-32(40)28(19-18-27-13-6-4-7-14-27)24-45(43,44)22-11-10-20-35-34(42)31-17-12-21-38(31)26(3)39/h4-9,13-16,25,28,30-31H,10-12,17-24H2,1-3H3,(H,35,42)(H,36,41)(H,37,40)(H,43,44)/t28-,30-,31+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 6.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibition of recombinant matrix metalloprotease-2 (MMP-2) |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50073839
(CHEMBL283066 | [4-(1,3-Dioxo-1,3-dihydro-isoindol-...)Show SMILES CC(C)C[C@@H](NC(=O)[C@H](CCc1ccccc1)CP(O)(=O)CCCCN1C(=O)c2ccccc2C1=O)C(=O)Nc1ccccc1 Show InChI InChI=1S/C35H42N3O6P/c1-25(2)23-31(33(40)36-28-15-7-4-8-16-28)37-32(39)27(20-19-26-13-5-3-6-14-26)24-45(43,44)22-12-11-21-38-34(41)29-17-9-10-18-30(29)35(38)42/h3-10,13-18,25,27,31H,11-12,19-24H2,1-2H3,(H,36,40)(H,37,39)(H,43,44)/t27-,31-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibition of recombinant matrix metalloprotease-2 (MMP-2) |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Stromelysin-1
(Homo sapiens (Human)) | BDBM50073823
(CHEMBL24871 | {4-[((S)-1-Acetyl-pyrrolidine-2-carb...)Show SMILES CC(C)C[C@@H](NC(=O)[C@H](CCc1ccccc1)CP(O)(=O)CCCCNC(=O)[C@@H]1CCCN1C(C)=O)C(=O)Nc1ccccc1 Show InChI InChI=1S/C34H49N4O6P/c1-25(2)23-30(33(41)36-29-15-8-5-9-16-29)37-32(40)28(19-18-27-13-6-4-7-14-27)24-45(43,44)22-11-10-20-35-34(42)31-17-12-21-38(31)26(3)39/h4-9,13-16,25,28,30-31H,10-12,17-24H2,1-3H3,(H,35,42)(H,36,41)(H,37,40)(H,43,44)/t28-,30-,31+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 62 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibition of recombinant matrix metalloprotease-3 (MMP-3) |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50073830
((4-Benzyl-benzyl)-[2-((R)-2,2-dimethyl-1-methylcar...)Show SMILES CNC(=O)[C@H](NC(=O)C(CCc1ccccc1)CP(O)(=O)Cc1ccc(Cc2ccccc2)cc1)C(C)(C)C Show InChI InChI=1S/C32H41N2O4P/c1-32(2,3)29(31(36)33-4)34-30(35)28(20-19-24-11-7-5-8-12-24)23-39(37,38)22-27-17-15-26(16-18-27)21-25-13-9-6-10-14-25/h5-18,28-29H,19-23H2,1-4H3,(H,33,36)(H,34,35)(H,37,38)/t28?,29-/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 | 14 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Matrix metalloproteinase-13 (MMP-13) |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50073822
((4-Benzyl-benzyl)-[2-((R)-2,2-dimethyl-1-methylcar...)Show SMILES CNC(=O)[C@H](NC(=O)C(CCCCOc1ccccc1)CP(O)(=O)Cc1ccc(Cc2ccccc2)cc1)C(C)(C)C Show InChI InChI=1S/C34H45N2O5P/c1-34(2,3)31(33(38)35-4)36-32(37)29(15-11-12-22-41-30-16-9-6-10-17-30)25-42(39,40)24-28-20-18-27(19-21-28)23-26-13-7-5-8-14-26/h5-10,13-14,16-21,29,31H,11-12,15,22-25H2,1-4H3,(H,35,38)(H,36,37)(H,39,40)/t29?,31-/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 | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Matrix metalloproteinase-13 (MMP-13) |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50073824
((4-Benzyl-benzyl)-[2-((R)-2,2-dimethyl-1-methylcar...)Show SMILES CNC(=O)[C@H](NC(=O)C(CCC(F)(F)F)CP(O)(=O)Cc1ccc(Cc2ccccc2)cc1)C(C)(C)C Show InChI InChI=1S/C27H36F3N2O4P/c1-26(2,3)23(25(34)31-4)32-24(33)22(14-15-27(28,29)30)18-37(35,36)17-21-12-10-20(11-13-21)16-19-8-6-5-7-9-19/h5-13,22-23H,14-18H2,1-4H3,(H,31,34)(H,32,33)(H,35,36)/t22?,23-/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 | 45 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant matrix metalloprotease-1 (MMP-1). |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50073833
((4-Benzyl-benzyl)-[2-((R)-2,2-dimethyl-1-methylcar...)Show SMILES CNC(=O)[C@H](NC(=O)C(CC(C)C)CP(O)(=O)Cc1ccc(Cc2ccccc2)cc1)C(C)(C)C Show InChI InChI=1S/C28H41N2O4P/c1-20(2)16-24(26(31)30-25(27(32)29-6)28(3,4)5)19-35(33,34)18-23-14-12-22(13-15-23)17-21-10-8-7-9-11-21/h7-15,20,24-25H,16-19H2,1-6H3,(H,29,32)(H,30,31)(H,33,34)/t24?,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 | 60 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant matrix metalloprotease-1 (MMP-1). |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50073831
((4-Benzyl-benzyl)-[3-cyclobutyl-2-((R)-2,2-dimethy...)Show SMILES CNC(=O)[C@H](NC(=O)C(CC1CCC1)CP(O)(=O)Cc1ccc(Cc2ccccc2)cc1)C(C)(C)C Show InChI InChI=1S/C29H41N2O4P/c1-29(2,3)26(28(33)30-4)31-27(32)25(18-22-11-8-12-22)20-36(34,35)19-24-15-13-23(14-16-24)17-21-9-6-5-7-10-21/h5-7,9-10,13-16,22,25-26H,8,11-12,17-20H2,1-4H3,(H,30,33)(H,31,32)(H,34,35)/t25?,26-/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 | 110 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Matrix metalloproteinase-13 (MMP-13) |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50073831
((4-Benzyl-benzyl)-[3-cyclobutyl-2-((R)-2,2-dimethy...)Show SMILES CNC(=O)[C@H](NC(=O)C(CC1CCC1)CP(O)(=O)Cc1ccc(Cc2ccccc2)cc1)C(C)(C)C Show InChI InChI=1S/C29H41N2O4P/c1-29(2,3)26(28(33)30-4)31-27(32)25(18-22-11-8-12-22)20-36(34,35)19-24-15-13-23(14-16-24)17-21-9-6-5-7-10-21/h5-7,9-10,13-16,22,25-26H,8,11-12,17-20H2,1-4H3,(H,30,33)(H,31,32)(H,34,35)/t25?,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 | 180 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant matrix metalloprotease-1 (MMP-1). |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50073833
((4-Benzyl-benzyl)-[2-((R)-2,2-dimethyl-1-methylcar...)Show SMILES CNC(=O)[C@H](NC(=O)C(CC(C)C)CP(O)(=O)Cc1ccc(Cc2ccccc2)cc1)C(C)(C)C Show InChI InChI=1S/C28H41N2O4P/c1-20(2)16-24(26(31)30-25(27(32)29-6)28(3,4)5)19-35(33,34)18-23-14-12-22(13-15-23)17-21-10-8-7-9-11-21/h7-15,20,24-25H,16-19H2,1-6H3,(H,29,32)(H,30,31)(H,33,34)/t24?,25-/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 | 180 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Matrix metalloproteinase-13 (MMP-13) |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50073837
((4-Benzyl-benzyl)-[3-cyclopropyl-2-((R)-2,2-dimeth...)Show SMILES CNC(=O)[C@H](NC(=O)C(CC1CC1)CP(O)(=O)Cc1ccc(Cc2ccccc2)cc1)C(C)(C)C Show InChI InChI=1S/C28H39N2O4P/c1-28(2,3)25(27(32)29-4)30-26(31)24(17-22-10-11-22)19-35(33,34)18-23-14-12-21(13-15-23)16-20-8-6-5-7-9-20/h5-9,12-15,22,24-25H,10-11,16-19H2,1-4H3,(H,29,32)(H,30,31)(H,33,34)/t24?,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 | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant matrix metalloprotease-1 (MMP-1). |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50073846
((4-Benzyl-benzyl)-{2-[(R)-2-(4-hydroxy-phenyl)-1-m...)Show SMILES CNC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)C(CC(C)C)CP(O)(=O)Cc1ccc(Cc2ccccc2)cc1 Show InChI InChI=1S/C31H39N2O5P/c1-22(2)17-27(30(35)33-29(31(36)32-3)19-25-13-15-28(34)16-14-25)21-39(37,38)20-26-11-9-24(10-12-26)18-23-7-5-4-6-8-23/h4-16,22,27,29,34H,17-21H2,1-3H3,(H,32,36)(H,33,35)(H,37,38)/t27?,29-/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 | 270 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant matrix metalloprotease-1 (MMP-1). |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50073828
(Benzyl-[2-((R)-2,2-dimethyl-1-methylcarbamoyl-prop...)Show SMILES CNC(=O)[C@H](NC(=O)C(CCc1ccccc1)CP(O)(=O)Cc1ccccc1)C(C)(C)C Show InChI InChI=1S/C25H35N2O4P/c1-25(2,3)22(24(29)26-4)27-23(28)21(16-15-19-11-7-5-8-12-19)18-32(30,31)17-20-13-9-6-10-14-20/h5-14,21-22H,15-18H2,1-4H3,(H,26,29)(H,27,28)(H,30,31)/t21?,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 | 300 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Matrix metalloproteinase-13 (MMP-13) |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM17807
(benzimidazole-urea, 34 | methyl N-(6-{[4-({[2-fluo...)Show SMILES COC(=O)Nc1nc2ccc(Sc3ccc(NC(=O)Nc4cc(ccc4F)C(F)(F)F)cc3)cc2[nH]1 Show InChI InChI=1S/C23H17F4N5O3S/c1-35-22(34)32-20-29-17-9-7-15(11-19(17)30-20)36-14-5-3-13(4-6-14)28-21(33)31-18-10-12(23(25,26)27)2-8-16(18)24/h2-11H,1H3,(H2,28,31,33)(H2,29,30,32,34) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| MCE
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 340 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant matrix metalloprotease-1 (MMP-1). |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50073830
((4-Benzyl-benzyl)-[2-((R)-2,2-dimethyl-1-methylcar...)Show SMILES CNC(=O)[C@H](NC(=O)C(CCc1ccccc1)CP(O)(=O)Cc1ccc(Cc2ccccc2)cc1)C(C)(C)C Show InChI InChI=1S/C32H41N2O4P/c1-32(2,3)29(31(36)33-4)34-30(35)28(20-19-24-11-7-5-8-12-24)23-39(37,38)22-27-17-15-26(16-18-27)21-25-13-9-6-10-14-25/h5-18,28-29H,19-23H2,1-4H3,(H,33,36)(H,34,35)(H,37,38)/t28?,29-/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 | 690 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant matrix metalloprotease-1 (MMP-1). |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50073834
((4-Benzoyl-benzyl)-[2-((R)-2,2-dimethyl-1-methylca...)Show SMILES CNC(=O)[C@H](NC(=O)C(CC(C)C)CP(O)(=O)Cc1ccc(cc1)C(=O)c1ccccc1)C(C)(C)C Show InChI InChI=1S/C28H39N2O5P/c1-19(2)16-23(26(32)30-25(27(33)29-6)28(3,4)5)18-36(34,35)17-20-12-14-22(15-13-20)24(31)21-10-8-7-9-11-21/h7-15,19,23,25H,16-18H2,1-6H3,(H,29,33)(H,30,32)(H,34,35)/t23?,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 | 750 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant matrix metalloprotease-1 (MMP-1). |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50073837
((4-Benzyl-benzyl)-[3-cyclopropyl-2-((R)-2,2-dimeth...)Show SMILES CNC(=O)[C@H](NC(=O)C(CC1CC1)CP(O)(=O)Cc1ccc(Cc2ccccc2)cc1)C(C)(C)C Show InChI InChI=1S/C28H39N2O4P/c1-28(2,3)25(27(32)29-4)30-26(31)24(17-22-10-11-22)19-35(33,34)18-23-14-12-21(13-15-23)16-20-8-6-5-7-9-20/h5-9,12-15,22,24-25H,10-11,16-19H2,1-4H3,(H,29,32)(H,30,31)(H,33,34)/t24?,25-/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 | 1.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Matrix metalloproteinase-13 (MMP-13) |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Stromelysin-1
(Homo sapiens (Human)) | BDBM50073830
((4-Benzyl-benzyl)-[2-((R)-2,2-dimethyl-1-methylcar...)Show SMILES CNC(=O)[C@H](NC(=O)C(CCc1ccccc1)CP(O)(=O)Cc1ccc(Cc2ccccc2)cc1)C(C)(C)C Show InChI InChI=1S/C32H41N2O4P/c1-32(2,3)29(31(36)33-4)34-30(35)28(20-19-24-11-7-5-8-12-24)23-39(37,38)22-27-17-15-26(16-18-27)21-25-13-9-6-10-14-25/h5-18,28-29H,19-23H2,1-4H3,(H,33,36)(H,34,35)(H,37,38)/t28?,29-/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 | 1.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibition of recombinant matrix metalloprotease-3 (MMP-3) |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50073841
((4-Benzyl-benzyl)-[3-cyclohexyl-2-((R)-2,2-dimethy...)Show SMILES CNC(=O)[C@H](NC(=O)C(CC1CCCCC1)CP(O)(=O)Cc1ccc(Cc2ccccc2)cc1)C(C)(C)C Show InChI InChI=1S/C31H45N2O4P/c1-31(2,3)28(30(35)32-4)33-29(34)27(20-24-13-9-6-10-14-24)22-38(36,37)21-26-17-15-25(16-18-26)19-23-11-7-5-8-12-23/h5,7-8,11-12,15-18,24,27-28H,6,9-10,13-14,19-22H2,1-4H3,(H,32,35)(H,33,34)(H,36,37)/t27?,28-/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 | 1.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Matrix metalloproteinase-13 (MMP-13) |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50073824
((4-Benzyl-benzyl)-[2-((R)-2,2-dimethyl-1-methylcar...)Show SMILES CNC(=O)[C@H](NC(=O)C(CCC(F)(F)F)CP(O)(=O)Cc1ccc(Cc2ccccc2)cc1)C(C)(C)C Show InChI InChI=1S/C27H36F3N2O4P/c1-26(2,3)23(25(34)31-4)32-24(33)22(14-15-27(28,29)30)18-37(35,36)17-21-12-10-20(11-13-21)16-19-8-6-5-7-9-19/h5-13,22-23H,14-18H2,1-4H3,(H,31,34)(H,32,33)(H,35,36)/t22?,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 | 1.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Matrix metalloproteinase-13 (MMP-13) |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50073829
((4-Benzenesulfonyl-benzyl)-{2-[(R)-2-(4-hydroxy-ph...)Show SMILES CNC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)C(CC(C)C)CP(O)(=O)Cc1ccc(cc1)S(=O)(=O)c1ccccc1 Show InChI InChI=1S/C30H37N2O7PS/c1-21(2)17-24(29(34)32-28(30(35)31-3)18-22-9-13-25(33)14-10-22)20-40(36,37)19-23-11-15-27(16-12-23)41(38,39)26-7-5-4-6-8-26/h4-16,21,24,28,33H,17-20H2,1-3H3,(H,31,35)(H,32,34)(H,36,37)/t24?,28-/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 | 1.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant matrix metalloprotease-1 (MMP-1). |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50073841
((4-Benzyl-benzyl)-[3-cyclohexyl-2-((R)-2,2-dimethy...)Show SMILES CNC(=O)[C@H](NC(=O)C(CC1CCCCC1)CP(O)(=O)Cc1ccc(Cc2ccccc2)cc1)C(C)(C)C Show InChI InChI=1S/C31H45N2O4P/c1-31(2,3)28(30(35)32-4)33-29(34)27(20-24-13-9-6-10-14-24)22-38(36,37)21-26-17-15-25(16-18-26)19-23-11-7-5-8-12-23/h5,7-8,11-12,15-18,24,27-28H,6,9-10,13-14,19-22H2,1-4H3,(H,32,35)(H,33,34)(H,36,37)/t27?,28-/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 | 1.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant matrix metalloprotease-1 (MMP-1). |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50073827
((4-Cyclohexylmethyl-benzyl)-{2-[(R)-2-(4-hydroxy-p...)Show SMILES CNC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)C(CC(C)C)CP(O)(=O)Cc1ccc(CC2CCCCC2)cc1 Show InChI InChI=1S/C31H45N2O5P/c1-22(2)17-27(30(35)33-29(31(36)32-3)19-25-13-15-28(34)16-14-25)21-39(37,38)20-26-11-9-24(10-12-26)18-23-7-5-4-6-8-23/h9-16,22-23,27,29,34H,4-8,17-21H2,1-3H3,(H,32,36)(H,33,35)(H,37,38)/t27?,29-/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 | 1.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant matrix metalloprotease-1 (MMP-1). |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50073826
((4-Benzyl-benzyl)-[4-cyclohexyl-2-((R)-2,2-dimethy...)Show SMILES CNC(=O)[C@H](NC(=O)C(CCC1CCCCC1)CP(O)(=O)Cc1ccc(Cc2ccccc2)cc1)C(C)(C)C Show InChI InChI=1S/C32H47N2O4P/c1-32(2,3)29(31(36)33-4)34-30(35)28(20-19-24-11-7-5-8-12-24)23-39(37,38)22-27-17-15-26(16-18-27)21-25-13-9-6-10-14-25/h6,9-10,13-18,24,28-29H,5,7-8,11-12,19-23H2,1-4H3,(H,33,36)(H,34,35)(H,37,38)/t28?,29-/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 | 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Matrix metalloproteinase-13 (MMP-13) |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50073842
((4-Benzylcarbamoyl-benzyl)-{2-[(R)-2-(4-methoxy-ph...)Show SMILES CNC(=O)[C@@H](Cc1ccc(OC)cc1)NC(=O)C(CC(C)C)CP(O)(=O)Cc1ccc(cc1)C(=O)NCc1ccccc1 Show InChI InChI=1S/C33H42N3O6P/c1-23(2)18-28(32(38)36-30(33(39)34-3)19-24-12-16-29(42-4)17-13-24)22-43(40,41)21-26-10-14-27(15-11-26)31(37)35-20-25-8-6-5-7-9-25/h5-17,23,28,30H,18-22H2,1-4H3,(H,34,39)(H,35,37)(H,36,38)(H,40,41)/t28?,30-/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 | 2.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant matrix metalloprotease-1 (MMP-1). |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50073835
(Biphenyl-4-ylmethyl-{2-[(R)-2-(4-hydroxy-phenyl)-1...)Show SMILES CNC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)C(CC(C)C)CP(O)(=O)Cc1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C30H37N2O5P/c1-21(2)17-26(29(34)32-28(30(35)31-3)18-22-11-15-27(33)16-12-22)20-38(36,37)19-23-9-13-25(14-10-23)24-7-5-4-6-8-24/h4-16,21,26,28,33H,17-20H2,1-3H3,(H,31,35)(H,32,34)(H,36,37)/t26?,28-/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 | 2.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant matrix metalloprotease-1 (MMP-1). |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50073838
((4-Benzyl-benzyl)-[4-methyl-2-((R)-1-methylcarbamo...)Show SMILES CNC(=O)[C@@H](C)NC(=O)C(CC(C)C)CP(O)(=O)Cc1ccc(Cc2ccccc2)cc1 Show InChI InChI=1S/C25H35N2O4P/c1-18(2)14-23(25(29)27-19(3)24(28)26-4)17-32(30,31)16-22-12-10-21(11-13-22)15-20-8-6-5-7-9-20/h5-13,18-19,23H,14-17H2,1-4H3,(H,26,28)(H,27,29)(H,30,31)/t19-,23?/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 | 2.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant matrix metalloprotease-1 (MMP-1). |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Stromelysin-1
(Homo sapiens (Human)) | BDBM50073828
(Benzyl-[2-((R)-2,2-dimethyl-1-methylcarbamoyl-prop...)Show SMILES CNC(=O)[C@H](NC(=O)C(CCc1ccccc1)CP(O)(=O)Cc1ccccc1)C(C)(C)C Show InChI InChI=1S/C25H35N2O4P/c1-25(2,3)22(24(29)26-4)27-23(28)21(16-15-19-11-7-5-8-12-19)18-32(30,31)17-20-13-9-6-10-14-20/h5-14,21-22H,15-18H2,1-4H3,(H,26,29)(H,27,28)(H,30,31)/t21?,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 | 2.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibition of recombinant matrix metalloprotease-3 (MMP-3) |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50073832
(CHEMBL25347 | {2-[(R)-2-(4-Hydroxy-phenyl)-1-methy...)Show SMILES CNC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)C(CC(C)C)CP(O)(=O)Cc1ccc(Oc2ccccc2)cc1 Show InChI InChI=1S/C30H37N2O6P/c1-21(2)17-24(29(34)32-28(30(35)31-3)18-22-9-13-25(33)14-10-22)20-39(36,37)19-23-11-15-27(16-12-23)38-26-7-5-4-6-8-26/h4-16,21,24,28,33H,17-20H2,1-3H3,(H,31,35)(H,32,34)(H,36,37)/t24?,28-/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 | 2.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant matrix metalloprotease-1 (MMP-1). |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Collagenase 3
(Homo sapiens (Human)) | BDBM50073836
((4-Benzyl-benzyl)-[2-((R)-2,2-dimethyl-1-methylcar...)Show SMILES CNC(=O)[C@H](NC(=O)C(CCC(C)C)CP(O)(=O)Cc1ccc(Cc2ccccc2)cc1)C(C)(C)C Show InChI InChI=1S/C29H43N2O4P/c1-21(2)12-17-25(27(32)31-26(28(33)30-6)29(3,4)5)20-36(34,35)19-24-15-13-23(14-16-24)18-22-10-8-7-9-11-22/h7-11,13-16,21,25-26H,12,17-20H2,1-6H3,(H,30,33)(H,31,32)(H,34,35)/t25?,26-/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 | >3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Matrix metalloproteinase-13 (MMP-13) |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50073836
((4-Benzyl-benzyl)-[2-((R)-2,2-dimethyl-1-methylcar...)Show SMILES CNC(=O)[C@H](NC(=O)C(CCC(C)C)CP(O)(=O)Cc1ccc(Cc2ccccc2)cc1)C(C)(C)C Show InChI InChI=1S/C29H43N2O4P/c1-21(2)12-17-25(27(32)31-26(28(33)30-6)29(3,4)5)20-36(34,35)19-24-15-13-23(14-16-24)18-22-10-8-7-9-11-22/h7-11,13-16,21,25-26H,12,17-20H2,1-6H3,(H,30,33)(H,31,32)(H,34,35)/t25?,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 | 3.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant matrix metalloprotease-1 (MMP-1). |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50073821
(CHEMBL284876 | {2-[(R)-2-(4-Hydroxy-phenyl)-1-meth...)Show SMILES CNC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)C(CC(C)C)CP(O)(=O)Cc1ccc(CC(C)C)cc1 Show InChI InChI=1S/C28H41N2O5P/c1-19(2)14-21-6-8-23(9-7-21)17-36(34,35)18-24(15-20(3)4)27(32)30-26(28(33)29-5)16-22-10-12-25(31)13-11-22/h6-13,19-20,24,26,31H,14-18H2,1-5H3,(H,29,33)(H,30,32)(H,34,35)/t24?,26-/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 | 4.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant matrix metalloprotease-1 (MMP-1). |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50073825
(Biphenyl-3-ylmethyl-{2-[(R)-2-(4-hydroxy-phenyl)-1...)Show SMILES CNC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)C(CC(C)C)CP(O)(=O)Cc1cccc(c1)-c1ccccc1 Show InChI InChI=1S/C30H37N2O5P/c1-21(2)16-26(29(34)32-28(30(35)31-3)18-22-12-14-27(33)15-13-22)20-38(36,37)19-23-8-7-11-25(17-23)24-9-5-4-6-10-24/h4-15,17,21,26,28,33H,16,18-20H2,1-3H3,(H,31,35)(H,32,34)(H,36,37)/t26?,28-/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 | 5.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant matrix metalloprotease-1 (MMP-1). |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50073843
(CHEMBL24290 | {2-[(R)-2-(4-Hydroxy-phenyl)-1-methy...)Show SMILES CNC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)C(CC(C)C)CP(O)(=O)Cc1cccc(CCc2ccccc2)c1 Show InChI InChI=1S/C32H41N2O5P/c1-23(2)18-28(31(36)34-30(32(37)33-3)20-26-14-16-29(35)17-15-26)22-40(38,39)21-27-11-7-10-25(19-27)13-12-24-8-5-4-6-9-24/h4-11,14-17,19,23,28,30,35H,12-13,18,20-22H2,1-3H3,(H,33,37)(H,34,36)(H,38,39)/t28?,30-/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 | 7.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant matrix metalloprotease-1 (MMP-1). |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50073844
(Biphenyl-2-ylmethyl-{2-[(R)-2-(4-hydroxy-phenyl)-1...)Show SMILES CNC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)C(CC(C)C)CP(O)(=O)Cc1ccccc1-c1ccccc1 Show InChI InChI=1S/C30H37N2O5P/c1-21(2)17-25(29(34)32-28(30(35)31-3)18-22-13-15-26(33)16-14-22)20-38(36,37)19-24-11-7-8-12-27(24)23-9-5-4-6-10-23/h4-16,21,25,28,33H,17-20H2,1-3H3,(H,31,35)(H,32,34)(H,36,37)/t25?,28-/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 | 1.10E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant matrix metalloprotease-1 (MMP-1). |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50073847
(Benzyl-{2-[(R)-2-(4-hydroxy-phenyl)-1-methylcarbam...)Show SMILES CNC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)C(CC(C)C)CP(O)(=O)Cc1ccccc1 Show InChI InChI=1S/C24H33N2O5P/c1-17(2)13-20(16-32(30,31)15-19-7-5-4-6-8-19)23(28)26-22(24(29)25-3)14-18-9-11-21(27)12-10-18/h4-12,17,20,22,27H,13-16H2,1-3H3,(H,25,29)(H,26,28)(H,30,31)/t20?,22-/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 | 1.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant matrix metalloprotease-1 (MMP-1). |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50073845
((4-Benzyl-benzyl)-[2-(1-hydroxymethyl-2,2-dimethyl...)Show SMILES CC(C)CC(CP(O)(=O)Cc1ccc(Cc2ccccc2)cc1)C(=O)NC(CO)C(C)(C)C Show InChI InChI=1S/C27H40NO4P/c1-20(2)15-24(26(30)28-25(17-29)27(3,4)5)19-33(31,32)18-23-13-11-22(12-14-23)16-21-9-7-6-8-10-21/h6-14,20,24-25,29H,15-19H2,1-5H3,(H,28,30)(H,31,32) | 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 | 1.80E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant matrix metalloprotease-1 (MMP-1). |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50073826
((4-Benzyl-benzyl)-[4-cyclohexyl-2-((R)-2,2-dimethy...)Show SMILES CNC(=O)[C@H](NC(=O)C(CCC1CCCCC1)CP(O)(=O)Cc1ccc(Cc2ccccc2)cc1)C(C)(C)C Show InChI InChI=1S/C32H47N2O4P/c1-32(2,3)29(31(36)33-4)34-30(35)28(20-19-24-11-7-5-8-12-24)23-39(37,38)22-27-17-15-26(16-18-27)21-25-13-9-6-10-14-25/h6,9-10,13-18,24,28-29H,5,7-8,11-12,19-23H2,1-4H3,(H,33,36)(H,34,35)(H,37,38)/t28?,29-/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 | 1.90E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant matrix metalloprotease-1 (MMP-1). |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50073848
((4-Benzyl-benzyl)-[2-(2,2-dimethyl-propylcarbamoyl...)Show SMILES CC(C)CC(CP(O)(=O)Cc1ccc(Cc2ccccc2)cc1)C(=O)NCC(C)(C)C Show InChI InChI=1S/C26H38NO3P/c1-20(2)15-24(25(28)27-19-26(3,4)5)18-31(29,30)17-23-13-11-22(12-14-23)16-21-9-7-6-8-10-21/h6-14,20,24H,15-19H2,1-5H3,(H,27,28)(H,29,30) | 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 | 2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant matrix metalloprotease-1 (MMP-1). |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50073828
(Benzyl-[2-((R)-2,2-dimethyl-1-methylcarbamoyl-prop...)Show SMILES CNC(=O)[C@H](NC(=O)C(CCc1ccccc1)CP(O)(=O)Cc1ccccc1)C(C)(C)C Show InChI InChI=1S/C25H35N2O4P/c1-25(2,3)22(24(29)26-4)27-23(28)21(16-15-19-11-7-5-8-12-19)18-32(30,31)17-20-13-9-6-10-14-20/h5-14,21-22H,15-18H2,1-4H3,(H,26,29)(H,27,28)(H,30,31)/t21?,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 | 2.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant matrix metalloprotease-1 (MMP-1). |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50073822
((4-Benzyl-benzyl)-[2-((R)-2,2-dimethyl-1-methylcar...)Show SMILES CNC(=O)[C@H](NC(=O)C(CCCCOc1ccccc1)CP(O)(=O)Cc1ccc(Cc2ccccc2)cc1)C(C)(C)C Show InChI InChI=1S/C34H45N2O5P/c1-34(2,3)31(33(38)35-4)36-32(37)29(15-11-12-22-41-30-16-9-6-10-17-30)25-42(39,40)24-28-20-18-27(19-21-28)23-26-13-7-5-8-14-26/h5-10,13-14,16-21,29,31H,11-12,15,22-25H2,1-4H3,(H,35,38)(H,36,37)(H,39,40)/t29?,31-/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 | >3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc
Curated by ChEMBL
| Assay Description
Inhibitory activity against recombinant matrix metalloprotease-1 (MMP-1). |
Bioorg Med Chem Lett 9: 127-32 (1999)
BindingDB Entry DOI: 10.7270/Q2JD4VZ4 |
More data for this
Ligand-Target Pair | |
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