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PubMed code 8254355

Compile data set for download or QSAR
Found 1 hit of Enzyme Inhibition Constant Data   
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
Endothelin receptor ET-A


(Sus scrofa)
BDBM50292412
PNG
(34-sulfatobastadin 13 | CHEMBL465400)
Show SMILES Oc1ccc2CCNC(=O)C(Cc3cc(Br)c(OS([O-])(=O)=O)c(Oc4c(Br)cc(CC(N=O)C(=O)NCCc5ccc(Oc1c2)c(Br)c5)cc4Br)c3)N=O
Show InChI InChI=1S/C34H28Br4N4O11S/c35-21-9-17-2-4-28(21)51-29-15-18(1-3-27(29)43)6-8-40-34(45)26(42-47)14-20-12-24(38)32(53-54(48,49)50)30(16-20)52-31-22(36)10-19(11-23(31)37)13-25(41-46)33(44)39-7-5-17/h1-4,9-12,15-16,25-26,43H,5-8,13-14H2,(H,39,44)(H,40,45)(H,48,49,50)/p-1
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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 3.90E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [125]ET1 from ETA receptor in pig thoracic aorta


J Nat Prod 56: 1613-1617 (1993)


Article DOI: 10.1021/np50099a026
BindingDB Entry DOI: 10.7270/Q2R211FR
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%