Found 7 hits of ki for monomerid = 50101507 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)) | BDBM50101507
((R)-3-(((S)-3-cyclohexyl-1-(3-methoxy-3-oxopropyla...)Show SMILES COC(=O)CCNC(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCCc1ccccc1)CC(O)=O Show InChI InChI=1S/C26H38N2O6/c1-34-24(31)15-16-27-26(33)22(17-20-11-6-3-7-12-20)28-25(32)21(18-23(29)30)14-8-13-19-9-4-2-5-10-19/h2,4-5,9-10,20-22H,3,6-8,11-18H2,1H3,(H,27,33)(H,28,32)(H,29,30)/t21-,22+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| 6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of the Gelatinase-A enzyme was determined from purified NSO cells. |
Bioorg Med Chem Lett 4: 2747-2752 (1994)
Article DOI: 10.1016/S0960-894X(01)80588-6
BindingDB Entry DOI: 10.7270/Q2JH3M3P |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50101507
((R)-3-(((S)-3-cyclohexyl-1-(3-methoxy-3-oxopropyla...)Show SMILES COC(=O)CCNC(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCCc1ccccc1)CC(O)=O Show InChI InChI=1S/C26H38N2O6/c1-34-24(31)15-16-27-26(33)22(17-20-11-6-3-7-12-20)28-25(32)21(18-23(29)30)14-8-13-19-9-4-2-5-10-19/h2,4-5,9-10,20-22H,3,6-8,11-18H2,1H3,(H,27,33)(H,28,32)(H,29,30)/t21-,22+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Royal Danish School of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibitory constant against matrix metalloproteinase-2 |
J Med Chem 44: 2333-43 (2001)
BindingDB Entry DOI: 10.7270/Q2JH3KFR |
More data for this
Ligand-Target Pair | |
Stromelysin-1
(Homo sapiens (Human)) | BDBM50101507
((R)-3-(((S)-3-cyclohexyl-1-(3-methoxy-3-oxopropyla...)Show SMILES COC(=O)CCNC(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCCc1ccccc1)CC(O)=O Show InChI InChI=1S/C26H38N2O6/c1-34-24(31)15-16-27-26(33)22(17-20-11-6-3-7-12-20)28-25(32)21(18-23(29)30)14-8-13-19-9-4-2-5-10-19/h2,4-5,9-10,20-22H,3,6-8,11-18H2,1H3,(H,27,33)(H,28,32)(H,29,30)/t21-,22+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| 1.47E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of the Stromelysin enzyme was determined from purified NSO cells. |
Bioorg Med Chem Lett 4: 2747-2752 (1994)
Article DOI: 10.1016/S0960-894X(01)80588-6
BindingDB Entry DOI: 10.7270/Q2JH3M3P |
More data for this
Ligand-Target Pair | |
Stromelysin-1
(Homo sapiens (Human)) | BDBM50101507
((R)-3-(((S)-3-cyclohexyl-1-(3-methoxy-3-oxopropyla...)Show SMILES COC(=O)CCNC(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCCc1ccccc1)CC(O)=O Show InChI InChI=1S/C26H38N2O6/c1-34-24(31)15-16-27-26(33)22(17-20-11-6-3-7-12-20)28-25(32)21(18-23(29)30)14-8-13-19-9-4-2-5-10-19/h2,4-5,9-10,20-22H,3,6-8,11-18H2,1H3,(H,27,33)(H,28,32)(H,29,30)/t21-,22+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 1.47E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Royal Danish School of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibitory constant against matrix metalloproteinase-3 |
J Med Chem 44: 2333-43 (2001)
BindingDB Entry DOI: 10.7270/Q2JH3KFR |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50101507
((R)-3-(((S)-3-cyclohexyl-1-(3-methoxy-3-oxopropyla...)Show SMILES COC(=O)CCNC(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCCc1ccccc1)CC(O)=O Show InChI InChI=1S/C26H38N2O6/c1-34-24(31)15-16-27-26(33)22(17-20-11-6-3-7-12-20)28-25(32)21(18-23(29)30)14-8-13-19-9-4-2-5-10-19/h2,4-5,9-10,20-22H,3,6-8,11-18H2,1H3,(H,27,33)(H,28,32)(H,29,30)/t21-,22+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 5.75E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pomona College
Curated by ChEMBL
| Assay Description
Inhibition of MMP1 |
Bioorg Med Chem 15: 2223-68 (2007)
Article DOI: 10.1016/j.bmc.2007.01.011
BindingDB Entry DOI: 10.7270/Q2571DBD |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50101507
((R)-3-(((S)-3-cyclohexyl-1-(3-methoxy-3-oxopropyla...)Show SMILES COC(=O)CCNC(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCCc1ccccc1)CC(O)=O Show InChI InChI=1S/C26H38N2O6/c1-34-24(31)15-16-27-26(33)22(17-20-11-6-3-7-12-20)28-25(32)21(18-23(29)30)14-8-13-19-9-4-2-5-10-19/h2,4-5,9-10,20-22H,3,6-8,11-18H2,1H3,(H,27,33)(H,28,32)(H,29,30)/t21-,22+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 5.78E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The Royal Danish School of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibitory constant against matrix metalloproteinase-1 |
J Med Chem 44: 2333-43 (2001)
BindingDB Entry DOI: 10.7270/Q2JH3KFR |
More data for this
Ligand-Target Pair | |
Interstitial collagenase
(Homo sapiens (Human)) | BDBM50101507
((R)-3-(((S)-3-cyclohexyl-1-(3-methoxy-3-oxopropyla...)Show SMILES COC(=O)CCNC(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCCc1ccccc1)CC(O)=O Show InChI InChI=1S/C26H38N2O6/c1-34-24(31)15-16-27-26(33)22(17-20-11-6-3-7-12-20)28-25(32)21(18-23(29)30)14-8-13-19-9-4-2-5-10-19/h2,4-5,9-10,20-22H,3,6-8,11-18H2,1H3,(H,27,33)(H,28,32)(H,29,30)/t21-,22+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| 5.78E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Inhibition of the Collagenase enzyme was determined from purified NSO cells. |
Bioorg Med Chem Lett 4: 2747-2752 (1994)
Article DOI: 10.1016/S0960-894X(01)80588-6
BindingDB Entry DOI: 10.7270/Q2JH3M3P |
More data for this
Ligand-Target Pair | |
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