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BDBM50514066 CHEMBL4589217

SMILES: CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C=O

InChI Key: InChIKey=GJRWZZORZFKXQE-BIHRQFPBSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50514066   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Plasminogen


(Homo sapiens (Human))
BDBM50514066
PNG
(CHEMBL4589217)
Show SMILES CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C=O |r|
Show InChI InChI=1S/C28H46N8O8S/c1-18(38)33-22(7-3-4-13-29)25(40)35-23(12-15-45(2,43)44)26(41)36-24(16-19-8-10-21(39)11-9-19)27(42)34-20(17-37)6-5-14-32-28(30)31/h8-11,17,20,22-24,39H,3-7,12-16,29H2,1-2H3,(H,33,38)(H,34,42)(H,35,40)(H,36,41)(H4,30,31,32)/t20-,22-,23-,24-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
3.30n/an/an/an/an/an/an/an/a



Philipps University Marburg

Curated by ChEMBL


Assay Description
Inhibition of human plasmin assessed as reduction in proteolysis activity in presence of fibrinogen after 90 mins by SDS-PAGE analysis


J Med Chem 63: 1445-1472 (2020)


Article DOI: 10.1021/acs.jmedchem.9b01060
More data for this
Ligand-Target Pair