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Compile Data Set for Download or QSAR

Found 2 hits of ic50 data for polymerid = 50006388   
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
Urea transporter 1


(Homo sapiens (Human))
BDBM50394962
PNG
(CHEMBL1394231)
Show SMILES CCc1ccc(cc1)S(=O)(=O)c1nnn2c3ccsc3c(NCc3cccs3)nc12
Show InChI InChI=1S/C20H17N5O2S3/c1-2-13-5-7-15(8-6-13)30(26,27)20-19-22-18(21-12-14-4-3-10-28-14)17-16(9-11-29-17)25(19)24-23-20/h3-11H,2,12H2,1H3,(H,21,22)
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CHEMBL
MCE
PC cid
PC sid
PDB
UniChem

Similars

PDB
Article
PubMed
n/an/a 11n/an/an/an/an/an/a



San Francisco State University

Curated by ChEMBL


Assay Description
Inhibition of UT-B in human erythrocytes assessed as increase of hypotonic lysis


Bioorg Med Chem Lett 23: 3338-41 (2013)


Article DOI: 10.1016/j.bmcl.2013.03.089
BindingDB Entry DOI: 10.7270/Q2CR5VRQ
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Urea transporter 1


(Homo sapiens (Human))
BDBM50512227
PNG
(CHEMBL4454312)
Show SMILES CC(=O)c1sc2nc3ccc(C)cc3cc2c1N
Show InChI InChI=1S/C14H12N2OS/c1-7-3-4-11-9(5-7)6-10-12(15)13(8(2)17)18-14(10)16-11/h3-6H,15H2,1-2H3
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.72E+3n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of urea transporter B in human erythrocytes incubated for 6 mins by spectrophotometric analysis based erythrocyte lysis assay


Eur J Med Chem 172: 131-142 (2019)


Article DOI: 10.1016/j.ejmech.2019.03.060
BindingDB Entry DOI: 10.7270/Q2C82DMK
More data for this
Ligand-Target Pair