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Compile Data Set for Download or QSAR

Found 5 hits Enz. Inhib. hit(s) with Target = 'Solute carrier family 22 member 4'   
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
Solute carrier family 22 member 4


(Rattus norvegicus)
BDBM35229
PNG
(3-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-N-met...)
Show SMILES CNCCCN1c2ccccc2CCc2ccccc12
Show InChI InChI=1S/C18H22N2/c1-19-13-6-14-20-17-9-4-2-7-15(17)11-12-16-8-3-5-10-18(16)20/h2-5,7-10,19H,6,11-14H2,1H3
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CHEMBL
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MCE
KEGG
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PC cid
PC sid
PDB
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Article
PubMed
n/an/a 8.00E+4n/an/an/an/an/an/a



Medical College of Georgia

Curated by ChEMBL


Assay Description
TP_TRANSPORTER: inhibition of TEA uptake in Octn1-HRPE cells


Biochim Biophys Acta 1466: 315-27 (2000)


Article DOI: 10.1016/s0005-2736(00)00189-9
BindingDB Entry DOI: 10.7270/Q2377CKS
More data for this
Ligand-Target Pair
Solute carrier family 22 member 4


(Rattus norvegicus)
BDBM50485565
PNG
(CHEMBL465179)
Show SMILES CN(C)c1nc(N)c(nc1Cl)C(=O)NC(N)=N
Show InChI InChI=1S/C8H12ClN7O/c1-16(2)6-4(9)13-3(5(10)14-6)7(17)15-8(11)12/h1-2H3,(H2,10,14)(H4,11,12,15,17)
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KEGG

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MCE
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.00E+5n/an/an/an/an/an/a



Medical College of Georgia

Curated by ChEMBL


Assay Description
TP_TRANSPORTER: inhibition of TEA uptake in Octn1-HRPE cells


Biochim Biophys Acta 1466: 315-27 (2000)


Article DOI: 10.1016/s0005-2736(00)00189-9
BindingDB Entry DOI: 10.7270/Q2377CKS
More data for this
Ligand-Target Pair
Solute carrier family 22 member 4


(Rattus norvegicus)
BDBM39344
PNG
(4-amino-N-[2-(diethylamino)ethyl]benzamide;hydroch...)
Show SMILES CCN(CC)CCNC(=O)c1ccc(N)cc1
Show InChI InChI=1S/C13H21N3O/c1-3-16(4-2)10-9-15-13(17)11-5-7-12(14)8-6-11/h5-8H,3-4,9-10,14H2,1-2H3,(H,15,17)
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DrugBank
MCE
KEGG
PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 1.00E+6n/an/an/an/an/an/a



Medical College of Georgia

Curated by ChEMBL


Assay Description
TP_TRANSPORTER: inhibition of TEA uptake in Octn1-HRPE cells


Biochim Biophys Acta 1466: 315-27 (2000)


Article DOI: 10.1016/s0005-2736(00)00189-9
BindingDB Entry DOI: 10.7270/Q2377CKS
More data for this
Ligand-Target Pair
Solute carrier family 22 member 4


(Rattus norvegicus)
BDBM50149890
PNG
(CHEMBL9324 | tetraethylammonium)
Show SMILES CC[N+](CC)(CC)CC
Show InChI InChI=1S/C8H20N/c1-5-9(6-2,7-3)8-4/h5-8H2,1-4H3/q+1
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CHEMBL
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KEGG
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PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 1.00E+6n/an/an/an/an/an/a



Medical College of Georgia

Curated by ChEMBL


Assay Description
TP_TRANSPORTER: inhibition of TEA uptake in Octn1-HRPE cells


Biochim Biophys Acta 1466: 315-27 (2000)


Article DOI: 10.1016/s0005-2736(00)00189-9
BindingDB Entry DOI: 10.7270/Q2377CKS
More data for this
Ligand-Target Pair
Solute carrier family 22 member 4


(Rattus norvegicus)
BDBM50103595
PNG
(Brumetadina | CHEBI:3699 | Cimetidine | Tagamet | ...)
Show SMILES CN\C(NC#N)=N/CCSCc1nc[nH]c1C
Show InChI InChI=1S/C10H16N6S/c1-8-9(16-7-15-8)5-17-4-3-13-10(12-2)14-6-11/h7H,3-5H2,1-2H3,(H,15,16)(H2,12,13,14)
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 1.50E+6n/an/an/an/an/an/a



Medical College of Georgia

Curated by ChEMBL


Assay Description
TP_TRANSPORTER: inhibition of TEA uptake in Octn1-HRPE cells


Biochim Biophys Acta 1466: 315-27 (2000)


Article DOI: 10.1016/s0005-2736(00)00189-9
BindingDB Entry DOI: 10.7270/Q2377CKS
More data for this
Ligand-Target Pair