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Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Acetylcholine Binding protein' and Ligand = 'BDBM91629'   
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
Acetylcholine Binding protein


(Lymnaea stagnalis)
BDBM91629
PNG
(14t | alpha7 agonists 14t)
Show SMILES CN1[C@H]2CC[C@@H]1C[C@H](C2)n1cc(COc2ccccc2-c2ccno2)nn1
Show InChI InChI=1S/C20H23N5O2/c1-24-15-6-7-16(24)11-17(10-15)25-12-14(22-23-25)13-26-19-5-3-2-4-18(19)20-8-9-21-27-20/h2-5,8-9,12,15-17H,6-7,10-11,13H2,1H3/t15-,16+,17-
PDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
25 -42.7n/an/an/an/an/a7.420



University of California, San Diego



Assay Description
Assay Description 2 Assays used to generate Ki or EC50 values. 1) SPA Assay - Quick screen binding assays were performed using 100 ?l of 0.2 mg/ml an...


Taylor Research Group

More data for this
Ligand-Target Pair
Acetylcholine Binding protein


(Aplysia Californica)
BDBM91629
PNG
(14t | alpha7 agonists 14t)
Show SMILES CN1[C@H]2CC[C@@H]1C[C@H](C2)n1cc(COc2ccccc2-c2ccno2)nn1
Show InChI InChI=1S/C20H23N5O2/c1-24-15-6-7-16(24)11-17(10-15)25-12-14(22-23-25)13-26-19-5-3-2-4-18(19)20-8-9-21-27-20/h2-5,8-9,12,15-17H,6-7,10-11,13H2,1H3/t15-,16+,17-
PDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
300 -36.6n/an/an/an/an/a7.420



University of California, San Diego



Assay Description
Assay Description 2 Assays used to generate Ki or EC50 values. 1) SPA Assay - Quick screen binding assays were performed using 100 ?l of 0.2 mg/ml an...


Taylor Research Group

More data for this
Ligand-Target Pair
Acetylcholine Binding protein


(Aplysia Californica)
BDBM91629
PNG
(14t | alpha7 agonists 14t)
Show SMILES CN1[C@H]2CC[C@@H]1C[C@H](C2)n1cc(COc2ccccc2-c2ccno2)nn1
Show InChI InChI=1S/C20H23N5O2/c1-24-15-6-7-16(24)11-17(10-15)25-12-14(22-23-25)13-26-19-5-3-2-4-18(19)20-8-9-21-27-20/h2-5,8-9,12,15-17H,6-7,10-11,13H2,1H3/t15-,16+,17-
PDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
500 -35.4n/an/an/an/an/a7.420



University of California, San Diego



Assay Description
Assay Description 2 Assays used to generate Ki or EC50 values. 1) SPA Assay - Quick screen binding assays were performed using 100 ?l of 0.2 mg/ml an...


Taylor Research Group

More data for this
Ligand-Target Pair
Acetylcholine Binding protein


(Aplysia Californica)
BDBM91629
PNG
(14t | alpha7 agonists 14t)
Show SMILES CN1[C@H]2CC[C@@H]1C[C@H](C2)n1cc(COc2ccccc2-c2ccno2)nn1
Show InChI InChI=1S/C20H23N5O2/c1-24-15-6-7-16(24)11-17(10-15)25-12-14(22-23-25)13-26-19-5-3-2-4-18(19)20-8-9-21-27-20/h2-5,8-9,12,15-17H,6-7,10-11,13H2,1H3/t15-,16+,17-
PDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
>5.00E+3>-29.7n/an/an/an/an/a7.420



University of California, San Diego



Assay Description
Assay Description 2 Assays used to generate Ki or EC50 values. 1) SPA Assay - Quick screen binding assays were performed using 100 ?l of 0.2 mg/ml an...


Taylor Research Group

More data for this
Ligand-Target Pair