Compile Data Set for Download or QSAR

Found 6 hits of ki for monomerid = 91622   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Acetylcholine-binding protein (Lymnaea stagnalis)	BDBM91622 (22q | alpha7 agonists 22q) Show SMILES CC(=O)c1c(OCc2cn(nn2)[C@H]2C[C@@H]3CC[C@H](C2)[N+]3(C)C)ccc2ccccc12 |TLB:9:12:15.16:19| Show InChI InChI=1S/C24H29N4O2/c1-16(29)24-22-7-5-4-6-17(22)8-11-23(24)30-15-18-14-27(26-25-18)19-12-20-9-10-21(13-19)28(20,2)3/h4-8,11,14,19-21H,9-10,12-13,15H2,1-3H3/q+1/t19-,20-,21+	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	160	-38.1	n/a	n/a	n/a	n/a	n/a	7.4	20
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 (2014) Article DOI: 10.1124/mol.112.080291 BindingDB Entry DOI: 10.7270/Q2805163
					More data for this Ligand-Target Pair
Soluble acetylcholine receptor (Aplysia Californica)	BDBM91622 (22q | alpha7 agonists 22q) Show SMILES CC(=O)c1c(OCc2cn(nn2)[C@H]2C[C@@H]3CC[C@H](C2)[N+]3(C)C)ccc2ccccc12 |TLB:9:12:15.16:19| Show InChI InChI=1S/C24H29N4O2/c1-16(29)24-22-7-5-4-6-17(22)8-11-23(24)30-15-18-14-27(26-25-18)19-12-20-9-10-21(13-19)28(20,2)3/h4-8,11,14,19-21H,9-10,12-13,15H2,1-3H3/q+1/t19-,20-,21+	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	200	-37.6	n/a	n/a	n/a	n/a	n/a	7.4	20
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 (2014) Article DOI: 10.1124/mol.112.080291 BindingDB Entry DOI: 10.7270/Q2805163
					More data for this Ligand-Target Pair
Soluble acetylcholine receptor (Aplysia Californica)	BDBM91622 (22q | alpha7 agonists 22q) Show SMILES CC(=O)c1c(OCc2cn(nn2)[C@H]2C[C@@H]3CC[C@H](C2)[N+]3(C)C)ccc2ccccc12 |TLB:9:12:15.16:19| Show InChI InChI=1S/C24H29N4O2/c1-16(29)24-22-7-5-4-6-17(22)8-11-23(24)30-15-18-14-27(26-25-18)19-12-20-9-10-21(13-19)28(20,2)3/h4-8,11,14,19-21H,9-10,12-13,15H2,1-3H3/q+1/t19-,20-,21+	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	300	-36.6	n/a	n/a	n/a	n/a	n/a	7.4	20
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 (2014) Article DOI: 10.1124/mol.112.080291 BindingDB Entry DOI: 10.7270/Q2805163
					More data for this Ligand-Target Pair
Soluble acetylcholine receptor (Aplysia Californica)	BDBM91622 (22q | alpha7 agonists 22q) Show SMILES CC(=O)c1c(OCc2cn(nn2)[C@H]2C[C@@H]3CC[C@H](C2)[N+]3(C)C)ccc2ccccc12 |TLB:9:12:15.16:19| Show InChI InChI=1S/C24H29N4O2/c1-16(29)24-22-7-5-4-6-17(22)8-11-23(24)30-15-18-14-27(26-25-18)19-12-20-9-10-21(13-19)28(20,2)3/h4-8,11,14,19-21H,9-10,12-13,15H2,1-3H3/q+1/t19-,20-,21+	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	900	-33.9	n/a	n/a	n/a	n/a	n/a	7.4	20
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 (2014) Article DOI: 10.1124/mol.112.080291 BindingDB Entry DOI: 10.7270/Q2805163
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A (Mus musculus (house mouse))	BDBM91622 (22q | alpha7 agonists 22q) Show SMILES CC(=O)c1c(OCc2cn(nn2)[C@H]2C[C@@H]3CC[C@H](C2)[N+]3(C)C)ccc2ccccc12 |TLB:9:12:15.16:19| Show InChI InChI=1S/C24H29N4O2/c1-16(29)24-22-7-5-4-6-17(22)8-11-23(24)30-15-18-14-27(26-25-18)19-12-20-9-10-21(13-19)28(20,2)3/h4-8,11,14,19-21H,9-10,12-13,15H2,1-3H3/q+1/t19-,20-,21+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	>3.00E+4	>-26.9	n/a	n/a	n/a	n/a	n/a	7.4	37
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 (2014) Article DOI: 10.1124/mol.112.080291 BindingDB Entry DOI: 10.7270/Q2805163
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-4 (Homo sapiens (Human))	BDBM91622 (22q | alpha7 agonists 22q) Show SMILES CC(=O)c1c(OCc2cn(nn2)[C@H]2C[C@@H]3CC[C@H](C2)[N+]3(C)C)ccc2ccccc12 |TLB:9:12:15.16:19| Show InChI InChI=1S/C24H29N4O2/c1-16(29)24-22-7-5-4-6-17(22)8-11-23(24)30-15-18-14-27(26-25-18)19-12-20-9-10-21(13-19)28(20,2)3/h4-8,11,14,19-21H,9-10,12-13,15H2,1-3H3/q+1/t19-,20-,21+	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	>3.00E+4	>-26.9	n/a	n/a	n/a	n/a	n/a	7.4	37
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 (2014) Article DOI: 10.1124/mol.112.080291 BindingDB Entry DOI: 10.7270/Q2805163
					More data for this Ligand-Target Pair