Found 11 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 |
|---|
Plasminogen activator inhibitor 1
(Homo sapiens (Human)) | BDBM50139534
(2-[2-Methoxy-6-({3-trifluoromethyl-4-[4-(3-trifluo...)Show SMILES COc1cccc(CNc2ccc(N3CCN(CC3)c3cccc(c3)C(F)(F)F)c(c2)C(F)(F)F)c1Oc1ccc(cc1C(O)=O)[N+]([O-])=O Show InChI InChI=1S/C33H28F6N4O6/c1-48-29-7-2-4-20(30(29)49-28-11-9-24(43(46)47)18-25(28)31(44)45)19-40-22-8-10-27(26(17-22)33(37,38)39)42-14-12-41(13-15-42)23-6-3-5-21(16-23)32(34,35)36/h2-11,16-18,40H,12-15,19H2,1H3,(H,44,45) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 500 | n/a | n/a | n/a | n/a | n/a | n/a |
Zydus Research Centre
Curated by ChEMBL
| Assay Description
Inhibition of human Plasminogen activator inhibitor 1 using HRP substrate after 30 mins by chromogenic assay |
Bioorg Med Chem Lett 21: 5701-6 (2011)
Article DOI: 10.1016/j.bmcl.2011.08.031
BindingDB Entry DOI: 10.7270/Q2B858JV |
More data for this
Ligand-Target Pair | |
Plasminogen activator inhibitor 1
(Homo sapiens (Human)) | BDBM50354841
(CHEMBL1834496)Show SMILES COc1cccc(Cn2ccc3cc(ccc23)N2CCN(CC2)c2cccc(c2)C(F)(F)F)c1Oc1ccc(cc1C(O)=O)[N+]([O-])=O Show InChI InChI=1S/C34H29F3N4O6/c1-46-31-7-2-4-23(32(31)47-30-11-9-27(41(44)45)20-28(30)33(42)43)21-40-13-12-22-18-26(8-10-29(22)40)39-16-14-38(15-17-39)25-6-3-5-24(19-25)34(35,36)37/h2-13,18-20H,14-17,21H2,1H3,(H,42,43) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Zydus Research Centre
Curated by ChEMBL
| Assay Description
Inhibition of human Plasminogen activator inhibitor 1 using HRP substrate after 30 mins by chromogenic assay |
Bioorg Med Chem Lett 21: 5701-6 (2011)
Article DOI: 10.1016/j.bmcl.2011.08.031
BindingDB Entry DOI: 10.7270/Q2B858JV |
More data for this
Ligand-Target Pair | |
Plasminogen activator inhibitor 1
(Homo sapiens (Human)) | BDBM50354839
(CHEMBL1834494)Show SMILES OC(=O)c1cc(ccc1Oc1ccccc1Cn1ccc2cc(ccc12)N1CCN(CC1)c1cccc(c1)C(F)(F)F)[N+]([O-])=O Show InChI InChI=1S/C33H27F3N4O5/c34-33(35,36)24-5-3-6-25(19-24)37-14-16-38(17-15-37)26-8-10-29-22(18-26)12-13-39(29)21-23-4-1-2-7-30(23)45-31-11-9-27(40(43)44)20-28(31)32(41)42/h1-13,18-20H,14-17,21H2,(H,41,42) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Zydus Research Centre
Curated by ChEMBL
| Assay Description
Inhibition of human Plasminogen activator inhibitor 1 using HRP substrate after 30 mins by chromogenic assay |
Bioorg Med Chem Lett 21: 5701-6 (2011)
Article DOI: 10.1016/j.bmcl.2011.08.031
BindingDB Entry DOI: 10.7270/Q2B858JV |
More data for this
Ligand-Target Pair | |
Plasminogen activator inhibitor 1
(Homo sapiens (Human)) | BDBM50354834
(CHEMBL1834489)Show SMILES COc1cccc(Cn2ccc3cc(ccc23)-c2ccc(OC(F)(F)F)cc2)c1Oc1ccc(cc1C(O)=O)[N+]([O-])=O Show InChI InChI=1S/C30H21F3N2O7/c1-40-27-4-2-3-21(28(27)41-26-12-8-22(35(38)39)16-24(26)29(36)37)17-34-14-13-20-15-19(7-11-25(20)34)18-5-9-23(10-6-18)42-30(31,32)33/h2-16H,17H2,1H3,(H,36,37) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Zydus Research Centre
Curated by ChEMBL
| Assay Description
Inhibition of human Plasminogen activator inhibitor 1 using HRP substrate after 30 mins by chromogenic assay |
Bioorg Med Chem Lett 21: 5701-6 (2011)
Article DOI: 10.1016/j.bmcl.2011.08.031
BindingDB Entry DOI: 10.7270/Q2B858JV |
More data for this
Ligand-Target Pair | |
Plasminogen activator inhibitor 1
(Homo sapiens (Human)) | BDBM50354835
(CHEMBL1834490)Show SMILES OC(=O)c1cc(ccc1Oc1ccccc1Cn1ccc2cc(ccc12)-c1ccc(OC(F)(F)F)cc1)[N+]([O-])=O Show InChI InChI=1S/C29H19F3N2O6/c30-29(31,32)40-23-9-5-18(6-10-23)19-7-11-25-20(15-19)13-14-33(25)17-21-3-1-2-4-26(21)39-27-12-8-22(34(37)38)16-24(27)28(35)36/h1-16H,17H2,(H,35,36) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Zydus Research Centre
Curated by ChEMBL
| Assay Description
Inhibition of human Plasminogen activator inhibitor 1 using HRP substrate after 30 mins by chromogenic assay |
Bioorg Med Chem Lett 21: 5701-6 (2011)
Article DOI: 10.1016/j.bmcl.2011.08.031
BindingDB Entry DOI: 10.7270/Q2B858JV |
More data for this
Ligand-Target Pair | |
Plasminogen activator inhibitor 1
(Homo sapiens (Human)) | BDBM50354840
(CHEMBL1834495)Show SMILES OC(=O)c1cc(ccc1Oc1ccccc1Cn1ncc2cc(ccc12)N1CCN(CC1)c1cccc(c1)C(F)(F)F)[N+]([O-])=O Show InChI InChI=1S/C32H26F3N5O5/c33-32(34,35)23-5-3-6-24(17-23)37-12-14-38(15-13-37)25-8-10-28-22(16-25)19-36-39(28)20-21-4-1-2-7-29(21)45-30-11-9-26(40(43)44)18-27(30)31(41)42/h1-11,16-19H,12-15,20H2,(H,41,42) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.46E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Zydus Research Centre
Curated by ChEMBL
| Assay Description
Inhibition of human Plasminogen activator inhibitor 1 using HRP substrate after 30 mins by chromogenic assay |
Bioorg Med Chem Lett 21: 5701-6 (2011)
Article DOI: 10.1016/j.bmcl.2011.08.031
BindingDB Entry DOI: 10.7270/Q2B858JV |
More data for this
Ligand-Target Pair | |
Plasminogen activator inhibitor 1
(Homo sapiens (Human)) | BDBM50149275
(2-(1-benzyl-5-(4-(trifluoromethoxy)phenyl)-1H-indo...)Show SMILES OC(=O)C(=O)c1cn(Cc2ccccc2)c2ccc(cc12)-c1ccc(OC(F)(F)F)cc1 Show InChI InChI=1S/C24H16F3NO4/c25-24(26,27)32-18-9-6-16(7-10-18)17-8-11-21-19(12-17)20(22(29)23(30)31)14-28(21)13-15-4-2-1-3-5-15/h1-12,14H,13H2,(H,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.48E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Zydus Research Centre
Curated by ChEMBL
| Assay Description
Inhibition of human Plasminogen activator inhibitor 1 using HRP substrate after 30 mins by chromogenic assay |
Bioorg Med Chem Lett 21: 5701-6 (2011)
Article DOI: 10.1016/j.bmcl.2011.08.031
BindingDB Entry DOI: 10.7270/Q2B858JV |
More data for this
Ligand-Target Pair | |
Plasminogen activator inhibitor 1
(Homo sapiens (Human)) | BDBM50354842
(CHEMBL1834497)Show SMILES COc1cccc(Cn2ccc3cc(ccc23)N2CCN(CC2)c2ccc(cc2)C(F)(F)F)c1Oc1ccc(cc1C(O)=O)[N+]([O-])=O Show InChI InChI=1S/C34H29F3N4O6/c1-46-31-4-2-3-23(32(31)47-30-12-10-27(41(44)45)20-28(30)33(42)43)21-40-14-13-22-19-26(9-11-29(22)40)39-17-15-38(16-18-39)25-7-5-24(6-8-25)34(35,36)37/h2-14,19-20H,15-18,21H2,1H3,(H,42,43) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Zydus Research Centre
Curated by ChEMBL
| Assay Description
Inhibition of human Plasminogen activator inhibitor 1 using HRP substrate after 30 mins by chromogenic assay |
Bioorg Med Chem Lett 21: 5701-6 (2011)
Article DOI: 10.1016/j.bmcl.2011.08.031
BindingDB Entry DOI: 10.7270/Q2B858JV |
More data for this
Ligand-Target Pair | |
Plasminogen activator inhibitor 1
(Homo sapiens (Human)) | BDBM50354837
(CHEMBL1834492)Show SMILES OC(=O)c1cc(ccc1Oc1ccccc1CN1CCc2cc(ccc12)N1CCN(CC1)c1cccc(c1)C(F)(F)F)[N+]([O-])=O Show InChI InChI=1S/C33H29F3N4O5/c34-33(35,36)24-5-3-6-25(19-24)37-14-16-38(17-15-37)26-8-10-29-22(18-26)12-13-39(29)21-23-4-1-2-7-30(23)45-31-11-9-27(40(43)44)20-28(31)32(41)42/h1-11,18-20H,12-17,21H2,(H,41,42) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.90E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Zydus Research Centre
Curated by ChEMBL
| Assay Description
Inhibition of human Plasminogen activator inhibitor 1 using HRP substrate after 30 mins by chromogenic assay |
Bioorg Med Chem Lett 21: 5701-6 (2011)
Article DOI: 10.1016/j.bmcl.2011.08.031
BindingDB Entry DOI: 10.7270/Q2B858JV |
More data for this
Ligand-Target Pair | |
Plasminogen activator inhibitor 1
(Homo sapiens (Human)) | BDBM50354838
(CHEMBL1834493)Show SMILES OC(=O)c1cc(ccc1Oc1ccccc1CN1CCCc2cc(ccc12)N1CCN(CC1)c1cccc(c1)C(F)(F)F)[N+]([O-])=O Show InChI InChI=1S/C34H31F3N4O5/c35-34(36,37)25-7-3-8-26(20-25)38-15-17-39(18-16-38)27-10-12-30-23(19-27)6-4-14-40(30)22-24-5-1-2-9-31(24)46-32-13-11-28(41(44)45)21-29(32)33(42)43/h1-3,5,7-13,19-21H,4,6,14-18,22H2,(H,42,43) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.38E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Zydus Research Centre
Curated by ChEMBL
| Assay Description
Inhibition of human Plasminogen activator inhibitor 1 using HRP substrate after 30 mins by chromogenic assay |
Bioorg Med Chem Lett 21: 5701-6 (2011)
Article DOI: 10.1016/j.bmcl.2011.08.031
BindingDB Entry DOI: 10.7270/Q2B858JV |
More data for this
Ligand-Target Pair | |
Plasminogen activator inhibitor 1
(Homo sapiens (Human)) | BDBM50354836
(CHEMBL1834491)Show SMILES COc1cccc(Cn2ccc3cc(ccc23)-c2ccccc2)c1Oc1ccc(cc1C(O)=O)[N+]([O-])=O Show InChI InChI=1S/C29H22N2O6/c1-36-27-9-5-8-22(28(27)37-26-13-11-23(31(34)35)17-24(26)29(32)33)18-30-15-14-21-16-20(10-12-25(21)30)19-6-3-2-4-7-19/h2-17H,18H2,1H3,(H,32,33) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 9.80E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Zydus Research Centre
Curated by ChEMBL
| Assay Description
Inhibition of human Plasminogen activator inhibitor 1 using HRP substrate after 30 mins by chromogenic assay |
Bioorg Med Chem Lett 21: 5701-6 (2011)
Article DOI: 10.1016/j.bmcl.2011.08.031
BindingDB Entry DOI: 10.7270/Q2B858JV |
More data for this
Ligand-Target Pair | |
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