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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'P2X purinoceptor 4' and Ligand = 'BDBM85044'   
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
P2X purinoceptor 4


(Homo sapiens (Human))
BDBM85044
PNG
(Bromphenol blue | Brophenol Blue | CAS_115-39-9 | ...)
Show SMILES Oc1c(Br)cc(cc1Br)C1(OS(=O)(=O)c2ccccc12)c1cc(Br)c(O)c(Br)c1
Show InChI InChI=1S/C19H10Br4O5S/c20-12-5-9(6-13(21)17(12)24)19(10-7-14(22)18(25)15(23)8-10)11-3-1-2-4-16(11)29(26,27)28-19/h1-8,24-25H
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
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Purchase

MCE
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
78.3n/an/an/an/an/an/an/an/a



Max-Planck Institute for Experimental Medicine

Curated by PDSP Ki Database




Mol Pharmacol 51: 109-18 (1997)


Article DOI: 10.1124/mol.51.1.109
BindingDB Entry DOI: 10.7270/Q218351B
More data for this
Ligand-Target Pair
P2X purinoceptor 4


(RAT)
BDBM85044
PNG
(Bromphenol blue | Brophenol Blue | CAS_115-39-9 | ...)
Show SMILES Oc1c(Br)cc(cc1Br)C1(OS(=O)(=O)c2ccccc12)c1cc(Br)c(O)c(Br)c1
Show InChI InChI=1S/C19H10Br4O5S/c20-12-5-9(6-13(21)17(12)24)19(10-7-14(22)18(25)15(23)8-10)11-3-1-2-4-16(11)29(26,27)28-19/h1-8,24-25H
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

MCE
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
302n/an/an/an/an/an/an/an/a



Max-Planck Institute for Experimental Medicine

Curated by PDSP Ki Database




Mol Pharmacol 51: 109-18 (1997)


Article DOI: 10.1124/mol.51.1.109
BindingDB Entry DOI: 10.7270/Q218351B
More data for this
Ligand-Target Pair