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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 240.3
BDBM86199
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 102 hits in this display   
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
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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PubMed
3.24E+3n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1B


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1B


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1D


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1D


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2C


(Rattus norvegicus (Rat))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2C


(Rattus norvegicus (Rat))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 5A


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 5A


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
Alpha-1B adrenergic receptor


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
Alpha-1B adrenergic receptor


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
Alpha-2A adrenergic receptor


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
Alpha-2A adrenergic receptor


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
Alpha-2B adrenergic receptor


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
Alpha-2C adrenergic receptor


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
Alpha-2C adrenergic receptor


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Rattus norvegicus (Rat))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Rattus norvegicus (Rat))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(Rattus norvegicus)
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(Rattus norvegicus)
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1C


(RAT)
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1C


(RAT)
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M4


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M4


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M5


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M5


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-2


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-2


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
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MCE
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Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-2


(Homo sapiens (Human))
BDBM86199
PNG
(CAS_595 | CAS_67678 | D-cystine | L-cystine | NSC_...)
Show SMILES NC(CSSCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)
PDB

Reactome pathway
KEGG

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antibodypedia
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MCE
KEGG
PC cid
PC sid
PDB
UniChem

Patents


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Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Case Western Reserve University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 305: 131-42 (2003)


Article DOI: 10.1124/jpet.102.047092
BindingDB Entry DOI: 10.7270/Q2VT1QN7
More data for this
Ligand-Target Pair
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