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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Plasmin' and Monomerid = 50046371   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Plasminogen


(Homo sapiens (Human))
BDBM50046371
PNG
(1-(2-Methoxy-2-phenyl-acetyl)-pyrrolidine-2-carbox...)
Show SMILES CO[C@H](C(=O)N1CCC[C@H]1C(=O)NC(CCCNC(N)=N)C=O)c1ccccc1
Show InChI InChI=1S/C20H29N5O4/c1-29-17(14-7-3-2-4-8-14)19(28)25-12-6-10-16(25)18(27)24-15(13-26)9-5-11-23-20(21)22/h2-4,7-8,13,15-17H,5-6,9-12H2,1H3,(H,24,27)(H4,21,22,23)/t15?,16-,17-/m0/s1
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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 1.50E+4n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Inhibitory activity against plasmin


J Med Chem 36: 314-9 (1993)


Article DOI: 10.1021/jm00055a002
BindingDB Entry DOI: 10.7270/Q2930S8J
More data for this
Ligand-Target Pair
Plasminogen


(Homo sapiens (Human))
BDBM50046371
PNG
(1-(2-Methoxy-2-phenyl-acetyl)-pyrrolidine-2-carbox...)
Show SMILES CO[C@H](C(=O)N1CCC[C@H]1C(=O)NC(CCCNC(N)=N)C=O)c1ccccc1
Show InChI InChI=1S/C20H29N5O4/c1-29-17(14-7-3-2-4-8-14)19(28)25-12-6-10-16(25)18(27)24-15(13-26)9-5-11-23-20(21)22/h2-4,7-8,13,15-17H,5-6,9-12H2,1H3,(H,24,27)(H4,21,22,23)/t15?,16-,17-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 8.60E+5n/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Compound was tested in vitro for inhibitory activity against t-PA (tissue plasminogen activator)


J Med Chem 36: 314-9 (1993)


Article DOI: 10.1021/jm00055a002
BindingDB Entry DOI: 10.7270/Q2930S8J
More data for this
Ligand-Target Pair