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PubMed code 1620241

Compile data set for download or QSAR
Found 6 hits 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
5-hydroxytryptamine 1D receptor


(Bos taurus (Bovine))
BDBM50056401
PNG
(2-diethylaminoethyl [2-methoxy-4-amino-5-chloro]be...)
Show SMILES CCN(CC)CCOC(=O)c1cc(Cl)c(N)cc1OC
Show InChI InChI=1S/C14H21ClN2O3/c1-4-17(5-2)6-7-20-14(18)10-8-11(15)12(16)9-13(10)19-3/h8-9H,4-7,16H2,1-3H3
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Article
PubMed
2.51E+3n/an/an/an/an/an/an/an/a



SANDOZ Pharma Ltd.

Curated by PDSP Ki Database




Naunyn Schmiedebergs Arch Pharmacol 345: 387-93 (1992)


Article DOI: 10.1007/bf00176615
BindingDB Entry DOI: 10.7270/Q2M043WM
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2C


(PIG)
BDBM50056401
PNG
(2-diethylaminoethyl [2-methoxy-4-amino-5-chloro]be...)
Show SMILES CCN(CC)CCOC(=O)c1cc(Cl)c(N)cc1OC
Show InChI InChI=1S/C14H21ClN2O3/c1-4-17(5-2)6-7-20-14(18)10-8-11(15)12(16)9-13(10)19-3/h8-9H,4-7,16H2,1-3H3
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PubMed
3.98E+3n/an/an/an/an/an/an/an/a



SANDOZ Pharma Ltd.

Curated by PDSP Ki Database




Naunyn Schmiedebergs Arch Pharmacol 345: 387-93 (1992)


Article DOI: 10.1007/bf00176615
BindingDB Entry DOI: 10.7270/Q2M043WM
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(CALF)
BDBM50056401
PNG
(2-diethylaminoethyl [2-methoxy-4-amino-5-chloro]be...)
Show SMILES CCN(CC)CCOC(=O)c1cc(Cl)c(N)cc1OC
Show InChI InChI=1S/C14H21ClN2O3/c1-4-17(5-2)6-7-20-14(18)10-8-11(15)12(16)9-13(10)19-3/h8-9H,4-7,16H2,1-3H3
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PubMed
6.31E+3n/an/an/an/an/an/an/an/a



SANDOZ Pharma Ltd.

Curated by PDSP Ki Database




Naunyn Schmiedebergs Arch Pharmacol 345: 387-93 (1992)


Article DOI: 10.1007/bf00176615
BindingDB Entry DOI: 10.7270/Q2M043WM
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50056401
PNG
(2-diethylaminoethyl [2-methoxy-4-amino-5-chloro]be...)
Show SMILES CCN(CC)CCOC(=O)c1cc(Cl)c(N)cc1OC
Show InChI InChI=1S/C14H21ClN2O3/c1-4-17(5-2)6-7-20-14(18)10-8-11(15)12(16)9-13(10)19-3/h8-9H,4-7,16H2,1-3H3
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



SANDOZ Pharma Ltd.

Curated by PDSP Ki Database




Naunyn Schmiedebergs Arch Pharmacol 345: 387-93 (1992)


Article DOI: 10.1007/bf00176615
BindingDB Entry DOI: 10.7270/Q2M043WM
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50056401
PNG
(2-diethylaminoethyl [2-methoxy-4-amino-5-chloro]be...)
Show SMILES CCN(CC)CCOC(=O)c1cc(Cl)c(N)cc1OC
Show InChI InChI=1S/C14H21ClN2O3/c1-4-17(5-2)6-7-20-14(18)10-8-11(15)12(16)9-13(10)19-3/h8-9H,4-7,16H2,1-3H3
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



SANDOZ Pharma Ltd.

Curated by PDSP Ki Database




Naunyn Schmiedebergs Arch Pharmacol 345: 387-93 (1992)


Article DOI: 10.1007/bf00176615
BindingDB Entry DOI: 10.7270/Q2M043WM
More data for this
Ligand-Target Pair
Alpha-2A adrenergic receptor


(BOVINE)
BDBM50056401
PNG
(2-diethylaminoethyl [2-methoxy-4-amino-5-chloro]be...)
Show SMILES CCN(CC)CCOC(=O)c1cc(Cl)c(N)cc1OC
Show InChI InChI=1S/C14H21ClN2O3/c1-4-17(5-2)6-7-20-14(18)10-8-11(15)12(16)9-13(10)19-3/h8-9H,4-7,16H2,1-3H3
PDB

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UniProtKB/SwissProt

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



SANDOZ Pharma Ltd.

Curated by PDSP Ki Database




Naunyn Schmiedebergs Arch Pharmacol 345: 387-93 (1992)


Article DOI: 10.1007/bf00176615
BindingDB Entry DOI: 10.7270/Q2M043WM
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%