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PubMed code 8155646

Compile data set for download or QSAR
Found 3 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 receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM21393
PNG
(7-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-o...)
Show SMILES CCCN(CCC)C1CCc2cccc(O)c2C1
Show InChI InChI=1S/C16H25NO/c1-3-10-17(11-4-2)14-9-8-13-6-5-7-16(18)15(13)12-14/h5-7,14,18H,3-4,8-12H2,1-2H3
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Article
PubMed
78n/an/an/an/an/an/an/an/a



Medical University of South Carolina

Curated by PDSP Ki Database




Biochemistry 33: 4283-90 (1994)


Article DOI: 10.1016/j.bioorg.2015.02.009
BindingDB Entry DOI: 10.7270/Q2X928TX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50005127
PNG
(1,1-Dioxo-2-[4-(4-pyrimidin-2-yl-piperazin-1-yl)-b...)
Show SMILES O=C1N(CCCCN2CCN(CC2)c2ncccn2)S(=O)(=O)c2ccccc12
Show InChI InChI=1S/C19H23N5O3S/c25-18-16-6-1-2-7-17(16)28(26,27)24(18)11-4-3-10-22-12-14-23(15-13-22)19-20-8-5-9-21-19/h1-2,5-9H,3-4,10-15H2
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Article
PubMed
130n/an/an/an/an/an/an/an/a



Medical University of South Carolina

Curated by PDSP Ki Database




Biochemistry 33: 4283-90 (1994)


Article DOI: 10.1016/j.bioorg.2015.02.009
BindingDB Entry DOI: 10.7270/Q2X928TX
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A (5-HT1A)


(Homo sapiens (Human))
BDBM50013515
PNG
((+)-yohimbine | (16alpha,17alpha)-17-hydroxyyohimb...)
Show SMILES COC(=O)[C@H]1[C@@H](O)CC[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12
Show InChI InChI=1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3/t12-,15-,17-,18-,19+/m0/s1
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Article
PubMed
1.50E+3n/an/an/an/an/an/an/an/a



Medical University of South Carolina

Curated by PDSP Ki Database




Biochemistry 33: 4283-90 (1994)


Article DOI: 10.1016/j.bioorg.2015.02.009
BindingDB Entry DOI: 10.7270/Q2X928TX
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%