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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Plasminogen' and Ligand = 'BDBM50292276'   
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))
BDBM50292276
PNG
(CHEMBL267585 | Cyclohexanone derivative)
Show SMILES COC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC[C@H]1CCC[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(=O)[C@@H](N)Cc2c[nH]c3ccccc23)C(=O)[C@@H](N)Cc2c[nH]c3ccccc23)C1=O)C(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)[C@@H](N)CC(C)C
Show InChI InChI=1S/C65H76N12O13/c1-34(2)26-43(66)60(83)55(64(87)89-3)76-62(85)52(57(80)44(67)27-37-30-70-47-20-10-7-17-40(37)47)74-51(78)25-24-36-16-13-23-50(56(36)79)73-61(84)53(58(81)45(68)28-38-31-71-48-21-11-8-18-41(38)48)75-63(86)54(77-65(88)90-33-35-14-5-4-6-15-35)59(82)46(69)29-39-32-72-49-22-12-9-19-42(39)49/h4-12,14-15,17-22,30-32,34,36,43-46,50,52-55,70-72H,13,16,23-29,33,66-69H2,1-3H3,(H,73,84)(H,74,78)(H,75,86)(H,76,85)(H,77,88)/t36-,43+,44+,45+,46+,50-,52+,53+,54+,55+/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.20E+3n/an/an/an/an/an/a



Brown University

Curated by ChEMBL


Assay Description
Inhibitory concentration against plasmin


J Med Chem 48: 6908-17 (2005)


Article DOI: 10.1021/jm050488k
BindingDB Entry DOI: 10.7270/Q24M959K
More data for this
Ligand-Target Pair