Compile Data Set for Download or QSAR

Found 1726 hits with Last Name = 'tanaka' and Initial = 'k'   

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
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50522827 (CHEMBL4519930) Show SMILES OC(C(=O)OC1C[N+]2(CCCc3ccc(Cl)cc3)CCC1CC2)(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C30H33ClNO3.BrH/c31-27-15-13-23(14-16-27)8-7-19-32-20-17-24(18-21-32)28(22-32)35-29(33)30(34,25-9-3-1-4-10-25)26-11-5-2-6-12-26;/h1-6,9-16,24,28,34H,7-8,17-22H2;1H/q+1;/p-1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.110	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Advanced Industrial Science and Technology (AIST) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M2R expressed in CHOK1 cell membranes incubated for 2 hrs by microbeta scintillation counting method				Bioorg Med Chem 27: 3339-3346 (2019) Article DOI: 10.1016/j.bmc.2019.06.016 BindingDB Entry DOI: 10.7270/Q2DR2ZXC
					More data for this Ligand-Target Pair
Protein kinase C theta type (Homo sapiens (Human))	BDBM50327943 (Aplysiatoxin | CHEMBL1256416) Show SMILES CO[C@@H](CC[C@H](C)[C@H]1O[C@@]23C[C@H](OC(=O)C[C@@H](OC(=O)C[C@](O)(O2)[C@H](C)CC3(C)C)[C@@H](C)O)[C@@H]1C)c1cc(O)ccc1Br |r| Show InChI InChI=1S/C32H47BrO10/c1-17(8-11-24(39-7)22-12-21(35)9-10-23(22)33)29-19(3)26-15-32(42-29)30(5,6)14-18(2)31(38,43-32)16-28(37)40-25(20(4)34)13-27(36)41-26/h9-10,12,17-20,24-26,29,34-35,38H,8,11,13-16H2,1-7H3/t17-,18+,19-,20+,24-,25+,26?,29+,31-,32-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	0.160	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Inhibition of [3H]PDBu binding to PKCtheta C1B peptide				Bioorg Med Chem Lett 20: 6064-6 (2010) Article DOI: 10.1016/j.bmcl.2010.08.051 BindingDB Entry DOI: 10.7270/Q2FJ2H04
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50522833 (CHEMBL4516342) Show SMILES OC(C(=O)OC1C[N+]2(CCCc3ccc(cc3)C(F)(F)F)CCC1CC2)(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C31H33F3NO3.BrH/c32-31(33,34)27-15-13-23(14-16-27)8-7-19-35-20-17-24(18-21-35)28(22-35)38-29(36)30(37,25-9-3-1-4-10-25)26-11-5-2-6-12-26;/h1-6,9-16,24,28,37H,7-8,17-22H2;1H/q+1;/p-1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.180	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Advanced Industrial Science and Technology (AIST) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M2R expressed in CHOK1 cell membranes incubated for 2 hrs by microbeta scintillation counting method				Bioorg Med Chem 27: 3339-3346 (2019) Article DOI: 10.1016/j.bmc.2019.06.016 BindingDB Entry DOI: 10.7270/Q2DR2ZXC
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM50375451 (CHEMBL408579) Show SMILES C[C@H](N)Cn1ncc2ccc3oc(C)cc3c12 Show InChI InChI=1S/C13H15N3O/c1-8(14)7-16-13-10(6-15-16)3-4-12-11(13)5-9(2)17-12/h3-6,8H,7,14H2,1-2H3/t8-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharma Inc. Curated by ChEMBL					Assay Description Displacement of [3H]5-HT from human 5HT2C receptor expressed in CHO cells				Bioorg Med Chem 16: 1966-82 (2008) Article DOI: 10.1016/j.bmc.2007.10.100 BindingDB Entry DOI: 10.7270/Q2TH8NKR
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM50375457 (CHEMBL261476) Show SMILES C[C@H](N)Cn1ncc2ccc3occc3c12 Show InChI InChI=1S/C12H13N3O/c1-8(13)7-15-12-9(6-14-15)2-3-11-10(12)4-5-16-11/h2-6,8H,7,13H2,1H3/t8-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharma Inc. Curated by ChEMBL					Assay Description Displacement of [3H]5-HT from human 5HT2C receptor expressed in CHO cells				Bioorg Med Chem 16: 1966-82 (2008) Article DOI: 10.1016/j.bmc.2007.10.100 BindingDB Entry DOI: 10.7270/Q2TH8NKR
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50239981 (Braltus | Spiriva | Spiriva Respimat | Tiotropium) Show SMILES [H][C@]12O[C@@]1([H])[C@]1([H])C[C@@]([H])(C[C@@]2([H])[N+]1(C)C)OC(=O)C(O)(c1cccs1)c1cccs1 |r,TLB:2:1:13:8.10.7,2:3:13:8.10.7,16:8:13:1.3| Show InChI InChI=1S/C19H22NO4S2/c1-20(2)12-9-11(10-13(20)17-16(12)24-17)23-18(21)19(22,14-5-3-7-25-14)15-6-4-8-26-15/h3-8,11-13,16-17,22H,9-10H2,1-2H3/q+1/t11-,12-,13+,16-,17+	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	0.200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Advanced Industrial Science and Technology (AIST) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M3R expressed in CHOK1 cell membranes incubated for 2 hrs by microbeta scintillation counting method				Bioorg Med Chem 27: 3339-3346 (2019) Article DOI: 10.1016/j.bmc.2019.06.016 BindingDB Entry DOI: 10.7270/Q2DR2ZXC
					More data for this Ligand-Target Pair
Protein kinase C eta type (Homo sapiens (Human))	BDBM50327943 (Aplysiatoxin | CHEMBL1256416) Show SMILES CO[C@@H](CC[C@H](C)[C@H]1O[C@@]23C[C@H](OC(=O)C[C@@H](OC(=O)C[C@](O)(O2)[C@H](C)CC3(C)C)[C@@H](C)O)[C@@H]1C)c1cc(O)ccc1Br |r| Show InChI InChI=1S/C32H47BrO10/c1-17(8-11-24(39-7)22-12-21(35)9-10-23(22)33)29-19(3)26-15-32(42-29)30(5,6)14-18(2)31(38,43-32)16-28(37)40-25(20(4)34)13-27(36)41-26/h9-10,12,17-20,24-26,29,34-35,38H,8,11,13-16H2,1-7H3/t17-,18+,19-,20+,24-,25+,26?,29+,31-,32-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	0.360	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Inhibition of [3H]PDBu binding to PKCeta C1B peptide				Bioorg Med Chem Lett 20: 6064-6 (2010) Article DOI: 10.1016/j.bmcl.2010.08.051 BindingDB Entry DOI: 10.7270/Q2FJ2H04
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50522829 (CHEMBL4457734) Show SMILES [Br-].OC(C(=O)OC1C[N+]2(CCSc3ccccc3)CCC1CC2)(c1ccccc1)c1ccccc1 |(58.41,-19.71,;49.43,-20.93,;50.77,-21.71,;52.1,-22.47,;52.11,-24.01,;53.44,-21.7,;54.77,-22.46,;56.1,-21.69,;57.43,-22.46,;58.76,-21.7,;60.1,-22.47,;61.43,-21.7,;62.76,-22.48,;62.76,-24.02,;64.09,-24.79,;65.43,-24.02,;65.42,-22.47,;64.09,-21.71,;57.43,-24.01,;56.1,-24.77,;54.77,-24.01,;56.27,-23.8,;55.92,-22.75,;50.76,-20.17,;52.1,-19.39,;52.09,-17.86,;50.75,-17.09,;49.42,-17.87,;49.43,-19.41,;49.44,-22.48,;48.1,-21.71,;46.77,-22.48,;46.77,-24.02,;48.12,-24.79,;49.45,-24.01,)| Show InChI InChI=1S/C29H32NO3S.BrH/c31-28(29(32,24-10-4-1-5-11-24)25-12-6-2-7-13-25)33-27-22-30(18-16-23(27)17-19-30)20-21-34-26-14-8-3-9-15-26;/h1-15,23,27,32H,16-22H2;1H/q+1;/p-1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.400	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Advanced Industrial Science and Technology (AIST) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M2R expressed in CHOK1 cell membranes incubated for 2 hrs by microbeta scintillation counting method				Bioorg Med Chem 27: 3339-3346 (2019) Article DOI: 10.1016/j.bmc.2019.06.016 BindingDB Entry DOI: 10.7270/Q2DR2ZXC
					More data for this Ligand-Target Pair
Protein kinase C alpha type (Homo sapiens (Human))	BDBM50327943 (Aplysiatoxin | CHEMBL1256416) Show SMILES CO[C@@H](CC[C@H](C)[C@H]1O[C@@]23C[C@H](OC(=O)C[C@@H](OC(=O)C[C@](O)(O2)[C@H](C)CC3(C)C)[C@@H](C)O)[C@@H]1C)c1cc(O)ccc1Br |r| Show InChI InChI=1S/C32H47BrO10/c1-17(8-11-24(39-7)22-12-21(35)9-10-23(22)33)29-19(3)26-15-32(42-29)30(5,6)14-18(2)31(38,43-32)16-28(37)40-25(20(4)34)13-27(36)41-26/h9-10,12,17-20,24-26,29,34-35,38H,8,11,13-16H2,1-7H3/t17-,18+,19-,20+,24-,25+,26?,29+,31-,32-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	0.400	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Inhibition of [3H]PDBu binding to PKC alpha C1A peptide				Bioorg Med Chem Lett 20: 6064-6 (2010) Article DOI: 10.1016/j.bmcl.2010.08.051 BindingDB Entry DOI: 10.7270/Q2FJ2H04
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50522832 (CHEMBL4483083) Show SMILES [Br-].OC(C(=O)O[C@H]1C[N+]2(CCCc3ccccc3)CCC1CC2)(c1ccccc1)c1ccccc1 |r,wU:6.4,(82.97,-35.31,;73.57,-37.16,;74.91,-37.93,;76.24,-38.7,;76.25,-40.24,;77.57,-37.92,;78.91,-38.69,;80.24,-37.91,;81.56,-38.69,;82.9,-37.92,;84.23,-38.69,;85.56,-37.93,;86.9,-38.7,;86.89,-40.24,;88.22,-41.01,;89.56,-40.24,;89.56,-38.7,;88.22,-37.93,;81.57,-40.23,;80.24,-40.99,;78.91,-40.23,;80.4,-40.03,;80.05,-38.98,;74.9,-36.39,;76.23,-35.62,;76.23,-34.08,;74.89,-33.31,;73.56,-34.1,;73.57,-35.63,;73.57,-38.7,;72.24,-37.93,;70.91,-38.7,;70.91,-40.25,;72.26,-41.01,;73.58,-40.24,)| Show InChI InChI=1S/C30H34NO3.BrH/c32-29(30(33,26-14-6-2-7-15-26)27-16-8-3-9-17-27)34-28-23-31(21-18-25(28)19-22-31)20-10-13-24-11-4-1-5-12-24;/h1-9,11-12,14-17,25,28,33H,10,13,18-23H2;1H/q+1;/p-1/t25?,28-,31?;/m0./s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.400	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Advanced Industrial Science and Technology (AIST) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M3R expressed in CHOK1 cell membranes incubated for 2 hrs by microbeta scintillation counting method				Bioorg Med Chem 27: 3339-3346 (2019) Article DOI: 10.1016/j.bmc.2019.06.016 BindingDB Entry DOI: 10.7270/Q2DR2ZXC
					More data for this Ligand-Target Pair
Protein kinase C delta type (Homo sapiens (Human))	BDBM50327943 (Aplysiatoxin | CHEMBL1256416) Show SMILES CO[C@@H](CC[C@H](C)[C@H]1O[C@@]23C[C@H](OC(=O)C[C@@H](OC(=O)C[C@](O)(O2)[C@H](C)CC3(C)C)[C@@H](C)O)[C@@H]1C)c1cc(O)ccc1Br |r| Show InChI InChI=1S/C32H47BrO10/c1-17(8-11-24(39-7)22-12-21(35)9-10-23(22)33)29-19(3)26-15-32(42-29)30(5,6)14-18(2)31(38,43-32)16-28(37)40-25(20(4)34)13-27(36)41-26/h9-10,12,17-20,24-26,29,34-35,38H,8,11,13-16H2,1-7H3/t17-,18+,19-,20+,24-,25+,26?,29+,31-,32-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	0.410	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Inhibition of [3H]PDBu binding to PKC delta C1B peptide				Bioorg Med Chem Lett 20: 6064-6 (2010) Article DOI: 10.1016/j.bmcl.2010.08.051 BindingDB Entry DOI: 10.7270/Q2FJ2H04
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50296331 ((3R)-3-{[Hydroxy(di-2-thienyl)acetyl]oxy}-1-(3-phe...) Show SMILES OC(C(=O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)(c1cccs1)c1cccs1 |r,wD:5.4,(-4.87,-33.87,;-5.96,-34.96,;-4.62,-35.72,;-4.61,-37.26,;-3.29,-34.95,;-1.95,-35.72,;-1.95,-37.26,;-.62,-38.02,;-.64,-39.56,;.69,-40.34,;2.03,-39.58,;3.36,-40.37,;4.7,-39.61,;6.02,-40.39,;7.36,-39.64,;7.37,-38.1,;6.04,-37.31,;4.7,-38.07,;.71,-37.26,;.71,-35.72,;-.62,-34.94,;-.2,-36.18,;-1.25,-36.53,;-5.96,-33.42,;-7.21,-32.51,;-6.74,-31.04,;-5.2,-31.04,;-4.72,-32.5,;-7.29,-35.73,;-8.7,-35.11,;-9.73,-36.25,;-8.96,-37.59,;-7.45,-37.26,)| Show InChI InChI=1S/C26H30NO4S2/c28-25(26(29,23-9-4-17-32-23)24-10-5-18-33-24)31-22-19-27(14-11-20(22)12-15-27)13-6-16-30-21-7-2-1-3-8-21/h1-5,7-10,17-18,20,22,29H,6,11-16,19H2/q+1/t20?,22-,27?/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid UniChem Similars	Article PubMed	0.430	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Advanced Industrial Science and Technology (AIST) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M2R expressed in CHOK1 cell membranes incubated for 2 hrs by microbeta scintillation counting method				Bioorg Med Chem 27: 3339-3346 (2019) Article DOI: 10.1016/j.bmc.2019.06.016 BindingDB Entry DOI: 10.7270/Q2DR2ZXC
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50522817 (CHEMBL4448944) Show SMILES [Br-].OC(C(=O)OC1C[N+]2(CCCc3ccccc3)CCC1CC2)(c1ccccc1)c1ccccc1 |(82.27,-32.47,;72.86,-34.32,;74.2,-35.09,;75.54,-35.86,;75.54,-37.4,;76.87,-35.08,;78.21,-35.85,;79.54,-35.07,;80.86,-35.85,;82.19,-35.08,;83.53,-35.85,;84.86,-35.09,;86.19,-35.86,;86.19,-37.4,;87.52,-38.17,;88.85,-37.4,;88.85,-35.86,;87.52,-35.09,;80.87,-37.39,;79.54,-38.15,;78.21,-37.39,;79.7,-37.19,;79.35,-36.14,;74.2,-33.55,;75.53,-32.78,;75.53,-31.24,;74.19,-30.47,;72.85,-31.26,;72.86,-32.79,;72.87,-35.86,;71.54,-35.09,;70.21,-35.86,;70.21,-37.41,;71.56,-38.17,;72.88,-37.39,)| Show InChI InChI=1S/C30H34NO3.BrH/c32-29(30(33,26-14-6-2-7-15-26)27-16-8-3-9-17-27)34-28-23-31(21-18-25(28)19-22-31)20-10-13-24-11-4-1-5-12-24;/h1-9,11-12,14-17,25,28,33H,10,13,18-23H2;1H/q+1;/p-1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.440	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Advanced Industrial Science and Technology (AIST) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M3R expressed in CHOK1 cell membranes incubated for 2 hrs by microbeta scintillation counting method				Bioorg Med Chem 27: 3339-3346 (2019) Article DOI: 10.1016/j.bmc.2019.06.016 BindingDB Entry DOI: 10.7270/Q2DR2ZXC
					More data for this Ligand-Target Pair
Protein kinase C beta type (Homo sapiens (Human))	BDBM50327943 (Aplysiatoxin | CHEMBL1256416) Show SMILES CO[C@@H](CC[C@H](C)[C@H]1O[C@@]23C[C@H](OC(=O)C[C@@H](OC(=O)C[C@](O)(O2)[C@H](C)CC3(C)C)[C@@H](C)O)[C@@H]1C)c1cc(O)ccc1Br |r| Show InChI InChI=1S/C32H47BrO10/c1-17(8-11-24(39-7)22-12-21(35)9-10-23(22)33)29-19(3)26-15-32(42-29)30(5,6)14-18(2)31(38,43-32)16-28(37)40-25(20(4)34)13-27(36)41-26/h9-10,12,17-20,24-26,29,34-35,38H,8,11,13-16H2,1-7H3/t17-,18+,19-,20+,24-,25+,26?,29+,31-,32-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	0.450	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Inhibition of [3H]PDBu binding to PKC beta C1A peptide				Bioorg Med Chem Lett 20: 6064-6 (2010) Article DOI: 10.1016/j.bmcl.2010.08.051 BindingDB Entry DOI: 10.7270/Q2FJ2H04
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50019290 (CHEMBL3289390) Show SMILES [Br-].C[N+]1(C)CCC[C@H](C1)OC(=O)C(O)(c1ccccc1)c1ccccc1 |r| Show InChI InChI=1S/C21H26NO3.BrH/c1-22(2)15-9-14-19(16-22)25-20(23)21(24,17-10-5-3-6-11-17)18-12-7-4-8-13-18;/h3-8,10-13,19,24H,9,14-16H2,1-2H3;1H/q+1;/p-1/t19-;/m1./s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.450	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Keio University Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M2R expressed in CHOK1 cells after 2 hrs by scintillation counting analysis				Bioorg Med Chem 22: 3488-97 (2014) Article DOI: 10.1016/j.bmc.2014.04.029 BindingDB Entry DOI: 10.7270/Q2VD7111
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50239981 (Braltus | Spiriva | Spiriva Respimat | Tiotropium) Show SMILES [H][C@]12O[C@@]1([H])[C@]1([H])C[C@@]([H])(C[C@@]2([H])[N+]1(C)C)OC(=O)C(O)(c1cccs1)c1cccs1 |r,TLB:2:1:13:8.10.7,2:3:13:8.10.7,16:8:13:1.3| Show InChI InChI=1S/C19H22NO4S2/c1-20(2)12-9-11(10-13(20)17-16(12)24-17)23-18(21)19(22,14-5-3-7-25-14)15-6-4-8-26-15/h3-8,11-13,16-17,22H,9-10H2,1-2H3/q+1/t11-,12-,13+,16-,17+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	0.490	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Advanced Industrial Science and Technology (AIST) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M2R expressed in CHOK1 cell membranes incubated for 2 hrs by microbeta scintillation counting method				Bioorg Med Chem 27: 3339-3346 (2019) Article DOI: 10.1016/j.bmc.2019.06.016 BindingDB Entry DOI: 10.7270/Q2DR2ZXC
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50522821 (CHEMBL4450188) Show SMILES [Br-].OC(C(=O)OC1C[N+]2(CCCc3ccc(F)cc3)CCC1CC2)(c1ccccc1)c1ccccc1 |(13.36,-19.18,;4.01,-20.28,;5.35,-21.05,;6.68,-21.82,;6.69,-23.36,;8.01,-21.04,;9.35,-21.81,;10.68,-21.03,;12,-21.81,;13.34,-21.04,;14.67,-21.82,;16,-21.05,;17.34,-21.82,;17.33,-23.36,;18.66,-24.13,;20,-23.36,;21.33,-24.14,;20,-21.82,;18.66,-21.05,;12.01,-23.35,;10.68,-24.11,;9.35,-23.35,;10.84,-23.15,;10.49,-22.1,;5.34,-19.51,;6.67,-18.74,;6.67,-17.2,;5.33,-16.43,;4,-17.22,;4.01,-18.75,;4.01,-21.83,;2.68,-21.05,;1.35,-21.83,;1.35,-23.37,;2.7,-24.13,;4.02,-23.36,)| Show InChI InChI=1S/C30H33FNO3.BrH/c31-27-15-13-23(14-16-27)8-7-19-32-20-17-24(18-21-32)28(22-32)35-29(33)30(34,25-9-3-1-4-10-25)26-11-5-2-6-12-26;/h1-6,9-16,24,28,34H,7-8,17-22H2;1H/q+1;/p-1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.490	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Advanced Industrial Science and Technology (AIST) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M2R expressed in CHOK1 cell membranes incubated for 2 hrs by microbeta scintillation counting method				Bioorg Med Chem 27: 3339-3346 (2019) Article DOI: 10.1016/j.bmc.2019.06.016 BindingDB Entry DOI: 10.7270/Q2DR2ZXC
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM50375452 (CHEMBL262092) Show SMILES COc1nn(C[C@H](C)N)c2c1ccc1occc21 Show InChI InChI=1S/C13H15N3O2/c1-8(14)7-16-12-9-5-6-18-11(9)4-3-10(12)13(15-16)17-2/h3-6,8H,7,14H2,1-2H3/t8-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.510	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharma Inc. Curated by ChEMBL					Assay Description Displacement of [3H]5-HT from human 5HT2C receptor expressed in CHO cells				Bioorg Med Chem 16: 1966-82 (2008) Article DOI: 10.1016/j.bmc.2007.10.100 BindingDB Entry DOI: 10.7270/Q2TH8NKR
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50522827 (CHEMBL4519930) Show SMILES OC(C(=O)OC1C[N+]2(CCCc3ccc(Cl)cc3)CCC1CC2)(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C30H33ClNO3.BrH/c31-27-15-13-23(14-16-27)8-7-19-32-20-17-24(18-21-32)28(22-32)35-29(33)30(34,25-9-3-1-4-10-25)26-11-5-2-6-12-26;/h1-6,9-16,24,28,34H,7-8,17-22H2;1H/q+1;/p-1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.510	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Advanced Industrial Science and Technology (AIST) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M3R expressed in CHOK1 cell membranes incubated for 2 hrs by microbeta scintillation counting method				Bioorg Med Chem 27: 3339-3346 (2019) Article DOI: 10.1016/j.bmc.2019.06.016 BindingDB Entry DOI: 10.7270/Q2DR2ZXC
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50296331 ((3R)-3-{[Hydroxy(di-2-thienyl)acetyl]oxy}-1-(3-phe...) Show SMILES OC(C(=O)O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)(c1cccs1)c1cccs1 |r,wD:5.4,(-4.87,-33.87,;-5.96,-34.96,;-4.62,-35.72,;-4.61,-37.26,;-3.29,-34.95,;-1.95,-35.72,;-1.95,-37.26,;-.62,-38.02,;-.64,-39.56,;.69,-40.34,;2.03,-39.58,;3.36,-40.37,;4.7,-39.61,;6.02,-40.39,;7.36,-39.64,;7.37,-38.1,;6.04,-37.31,;4.7,-38.07,;.71,-37.26,;.71,-35.72,;-.62,-34.94,;-.2,-36.18,;-1.25,-36.53,;-5.96,-33.42,;-7.21,-32.51,;-6.74,-31.04,;-5.2,-31.04,;-4.72,-32.5,;-7.29,-35.73,;-8.7,-35.11,;-9.73,-36.25,;-8.96,-37.59,;-7.45,-37.26,)| Show InChI InChI=1S/C26H30NO4S2/c28-25(26(29,23-9-4-17-32-23)24-10-5-18-33-24)31-22-19-27(14-11-20(22)12-15-27)13-6-16-30-21-7-2-1-3-8-21/h1-5,7-10,17-18,20,22,29H,6,11-16,19H2/q+1/t20?,22-,27?/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid UniChem Similars	DrugBank Article PubMed	0.560	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Advanced Industrial Science and Technology (AIST) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M3R expressed in CHOK1 cell membranes incubated for 2 hrs by microbeta scintillation counting method				Bioorg Med Chem 27: 3339-3346 (2019) Article DOI: 10.1016/j.bmc.2019.06.016 BindingDB Entry DOI: 10.7270/Q2DR2ZXC
					More data for this Ligand-Target Pair
Protein kinase C gamma type (Homo sapiens (Human))	BDBM50327943 (Aplysiatoxin | CHEMBL1256416) Show SMILES CO[C@@H](CC[C@H](C)[C@H]1O[C@@]23C[C@H](OC(=O)C[C@@H](OC(=O)C[C@](O)(O2)[C@H](C)CC3(C)C)[C@@H](C)O)[C@@H]1C)c1cc(O)ccc1Br |r| Show InChI InChI=1S/C32H47BrO10/c1-17(8-11-24(39-7)22-12-21(35)9-10-23(22)33)29-19(3)26-15-32(42-29)30(5,6)14-18(2)31(38,43-32)16-28(37)40-25(20(4)34)13-27(36)41-26/h9-10,12,17-20,24-26,29,34-35,38H,8,11,13-16H2,1-7H3/t17-,18+,19-,20+,24-,25+,26?,29+,31-,32-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	0.630	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Inhibition of [3H]PDBu binding to PKC gamma C1A peptide				Bioorg Med Chem Lett 20: 6064-6 (2010) Article DOI: 10.1016/j.bmcl.2010.08.051 BindingDB Entry DOI: 10.7270/Q2FJ2H04
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50522829 (CHEMBL4457734) Show SMILES [Br-].OC(C(=O)OC1C[N+]2(CCSc3ccccc3)CCC1CC2)(c1ccccc1)c1ccccc1 |(58.41,-19.71,;49.43,-20.93,;50.77,-21.71,;52.1,-22.47,;52.11,-24.01,;53.44,-21.7,;54.77,-22.46,;56.1,-21.69,;57.43,-22.46,;58.76,-21.7,;60.1,-22.47,;61.43,-21.7,;62.76,-22.48,;62.76,-24.02,;64.09,-24.79,;65.43,-24.02,;65.42,-22.47,;64.09,-21.71,;57.43,-24.01,;56.1,-24.77,;54.77,-24.01,;56.27,-23.8,;55.92,-22.75,;50.76,-20.17,;52.1,-19.39,;52.09,-17.86,;50.75,-17.09,;49.42,-17.87,;49.43,-19.41,;49.44,-22.48,;48.1,-21.71,;46.77,-22.48,;46.77,-24.02,;48.12,-24.79,;49.45,-24.01,)| Show InChI InChI=1S/C29H32NO3S.BrH/c31-28(29(32,24-10-4-1-5-11-24)25-12-6-2-7-13-25)33-27-22-30(18-16-23(27)17-19-30)20-21-34-26-14-8-3-9-15-26;/h1-15,23,27,32H,16-22H2;1H/q+1;/p-1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.650	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Advanced Industrial Science and Technology (AIST) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M3R expressed in CHOK1 cell membranes incubated for 2 hrs by microbeta scintillation counting method				Bioorg Med Chem 27: 3339-3346 (2019) Article DOI: 10.1016/j.bmc.2019.06.016 BindingDB Entry DOI: 10.7270/Q2DR2ZXC
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50522814 (CHEMBL4461243) Show SMILES [Br-].OC(C(=O)OC1C[N+]2(CCCOc3ccccc3)CCC1CC2)(c1ccccc1)c1ccccc1 |(13.28,-19.41,;3.37,-21.2,;4.71,-21.98,;6.04,-22.74,;6.05,-24.28,;7.38,-21.97,;8.71,-22.74,;10.04,-21.96,;11.36,-22.74,;12.7,-21.97,;14.03,-22.74,;15.37,-21.97,;16.7,-22.75,;18.03,-21.98,;19.36,-22.76,;20.69,-21.99,;20.7,-20.45,;19.36,-19.68,;18.03,-20.45,;11.37,-24.28,;10.04,-25.04,;8.71,-24.28,;10.2,-24.07,;9.85,-23.02,;4.7,-20.44,;6.03,-19.67,;6.03,-18.13,;4.69,-17.36,;3.36,-18.14,;3.37,-19.68,;3.38,-22.75,;2.04,-21.98,;.71,-22.75,;.72,-24.29,;2.06,-25.06,;3.39,-24.28,)| Show InChI InChI=1S/C30H34NO4.BrH/c32-29(30(33,25-11-4-1-5-12-25)26-13-6-2-7-14-26)35-28-23-31(20-17-24(28)18-21-31)19-10-22-34-27-15-8-3-9-16-27;/h1-9,11-16,24,28,33H,10,17-23H2;1H/q+1;/p-1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.680	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Advanced Industrial Science and Technology (AIST) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M2R expressed in CHOK1 cell membranes incubated for 2 hrs by microbeta scintillation counting method				Bioorg Med Chem 27: 3339-3346 (2019) Article DOI: 10.1016/j.bmc.2019.06.016 BindingDB Entry DOI: 10.7270/Q2DR2ZXC
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50377964 (Cantil | Glycophenylate | MEPENZOLATE BROMIDE | Me...) Show SMILES C[N+]1(C)CCCC(C1)OC(=O)C(O)(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C21H26NO3/c1-22(2)15-9-14-19(16-22)25-20(23)21(24,17-10-5-3-6-11-17)18-12-7-4-8-13-18/h3-8,10-13,19,24H,9,14-16H2,1-2H3/q+1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase DrugBank PC cid PC sid UniChem Similars	Article PubMed	0.680	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Keio University Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M2R expressed in CHOK1 cells after 2 hrs by scintillation counting analysis				Bioorg Med Chem 22: 3488-97 (2014) Article DOI: 10.1016/j.bmc.2014.04.029 BindingDB Entry DOI: 10.7270/Q2VD7111
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50522818 (CHEMBL4436930) Show SMILES [Br-].OC(C(=O)OC1C[N+]2(CCCc3cccc(F)c3)CCC1CC2)(c1ccccc1)c1ccccc1 |(60.41,-49.31,;51.01,-51.16,;52.35,-51.94,;53.68,-52.7,;53.69,-54.24,;55.02,-51.93,;56.35,-52.7,;57.68,-51.92,;59,-52.7,;60.34,-51.93,;61.67,-52.7,;63.01,-51.93,;64.34,-52.71,;65.67,-51.94,;67,-52.7,;67,-54.25,;65.66,-55.02,;65.66,-56.56,;64.33,-54.25,;59.01,-54.24,;57.68,-55,;56.35,-54.24,;57.84,-54.03,;57.49,-52.98,;52.34,-50.4,;53.67,-49.63,;53.67,-48.09,;52.33,-47.32,;51,-48.1,;51.01,-49.64,;51.02,-52.71,;49.68,-51.94,;48.35,-52.71,;48.36,-54.25,;49.7,-55.02,;51.03,-54.24,)| Show InChI InChI=1S/C30H33FNO3.BrH/c31-27-15-7-9-23(21-27)10-8-18-32-19-16-24(17-20-32)28(22-32)35-29(33)30(34,25-11-3-1-4-12-25)26-13-5-2-6-14-26;/h1-7,9,11-15,21,24,28,34H,8,10,16-20,22H2;1H/q+1;/p-1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.690	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Advanced Industrial Science and Technology (AIST) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M2R expressed in CHOK1 cell membranes incubated for 2 hrs by microbeta scintillation counting method				Bioorg Med Chem 27: 3339-3346 (2019) Article DOI: 10.1016/j.bmc.2019.06.016 BindingDB Entry DOI: 10.7270/Q2DR2ZXC
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50522817 (CHEMBL4448944) Show SMILES [Br-].OC(C(=O)OC1C[N+]2(CCCc3ccccc3)CCC1CC2)(c1ccccc1)c1ccccc1 |(82.27,-32.47,;72.86,-34.32,;74.2,-35.09,;75.54,-35.86,;75.54,-37.4,;76.87,-35.08,;78.21,-35.85,;79.54,-35.07,;80.86,-35.85,;82.19,-35.08,;83.53,-35.85,;84.86,-35.09,;86.19,-35.86,;86.19,-37.4,;87.52,-38.17,;88.85,-37.4,;88.85,-35.86,;87.52,-35.09,;80.87,-37.39,;79.54,-38.15,;78.21,-37.39,;79.7,-37.19,;79.35,-36.14,;74.2,-33.55,;75.53,-32.78,;75.53,-31.24,;74.19,-30.47,;72.85,-31.26,;72.86,-32.79,;72.87,-35.86,;71.54,-35.09,;70.21,-35.86,;70.21,-37.41,;71.56,-38.17,;72.88,-37.39,)| Show InChI InChI=1S/C30H34NO3.BrH/c32-29(30(33,26-14-6-2-7-15-26)27-16-8-3-9-17-27)34-28-23-31(21-18-25(28)19-22-31)20-10-13-24-11-4-1-5-12-24;/h1-9,11-12,14-17,25,28,33H,10,13,18-23H2;1H/q+1;/p-1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.720	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Advanced Industrial Science and Technology (AIST) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M2R expressed in CHOK1 cell membranes incubated for 2 hrs by microbeta scintillation counting method				Bioorg Med Chem 27: 3339-3346 (2019) Article DOI: 10.1016/j.bmc.2019.06.016 BindingDB Entry DOI: 10.7270/Q2DR2ZXC
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50375457 (CHEMBL261476) Show SMILES C[C@H](N)Cn1ncc2ccc3occc3c12 Show InChI InChI=1S/C12H13N3O/c1-8(13)7-15-12-9(6-14-15)2-3-11-10(12)4-5-16-11/h2-6,8H,7,13H2,1H3/t8-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.780	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharma Inc. Curated by ChEMBL					Assay Description Displacement of [3H]5-HT from human 5HT2A receptor expressed in CHO cells				Bioorg Med Chem 16: 1966-82 (2008) Article DOI: 10.1016/j.bmc.2007.10.100 BindingDB Entry DOI: 10.7270/Q2TH8NKR
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50375451 (CHEMBL408579) Show SMILES C[C@H](N)Cn1ncc2ccc3oc(C)cc3c12 Show InChI InChI=1S/C13H15N3O/c1-8(14)7-16-13-10(6-15-16)3-4-12-11(13)5-9(2)17-12/h3-6,8H,7,14H2,1-2H3/t8-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.780	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharma Inc. Curated by ChEMBL					Assay Description Displacement of [3H]5-HT from human 5HT2A receptor expressed in CHO cells				Bioorg Med Chem 16: 1966-82 (2008) Article DOI: 10.1016/j.bmc.2007.10.100 BindingDB Entry DOI: 10.7270/Q2TH8NKR
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50417445 (AHR-504 | CUVPOSA | GLYCOPYRROLATE) Show SMILES C[N+]1(C)CCC(C1)OC(=O)C(O)(C1CCCC1)c1ccccc1 Show InChI InChI=1S/C19H28NO3/c1-20(2)13-12-17(14-20)23-18(21)19(22,16-10-6-7-11-16)15-8-4-3-5-9-15/h3-5,8-9,16-17,22H,6-7,10-14H2,1-2H3/q+1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase DrugBank MCE PC cid PC sid UniChem Similars	DrugBank Article PubMed	0.810	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Advanced Industrial Science and Technology (AIST) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M3R expressed in CHOK1 cell membranes incubated for 2 hrs by microbeta scintillation counting method				Bioorg Med Chem 27: 3339-3346 (2019) Article DOI: 10.1016/j.bmc.2019.06.016 BindingDB Entry DOI: 10.7270/Q2DR2ZXC
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50522809 (CHEMBL4540604) Show SMILES [Br-].OC(C(=O)OC1C[N+]2(CCc3ccccc3)CCC1CC2)(c1ccccc1)c1ccccc1 |(59.77,-32.99,;51.72,-34.99,;53.06,-35.76,;54.4,-36.53,;54.4,-38.07,;55.73,-35.75,;57.07,-36.52,;58.4,-35.74,;59.72,-36.52,;61.06,-35.75,;62.39,-36.52,;63.72,-35.76,;65.05,-36.54,;66.39,-35.77,;66.39,-34.23,;65.05,-33.46,;63.72,-34.23,;59.73,-38.06,;58.4,-38.82,;57.07,-38.06,;58.56,-37.86,;58.21,-36.81,;53.06,-34.22,;54.39,-33.45,;54.39,-31.91,;53.05,-31.14,;51.71,-31.93,;51.72,-33.46,;51.73,-36.53,;50.4,-35.76,;49.07,-36.53,;49.07,-38.08,;50.42,-38.84,;51.74,-38.06,)| Show InChI InChI=1S/C29H32NO3.BrH/c31-28(29(32,25-12-6-2-7-13-25)26-14-8-3-9-15-26)33-27-22-30(20-17-24(27)18-21-30)19-16-23-10-4-1-5-11-23;/h1-15,24,27,32H,16-22H2;1H/q+1;/p-1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.860	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Advanced Industrial Science and Technology (AIST) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M3R expressed in CHOK1 cell membranes incubated for 2 hrs by microbeta scintillation counting method				Bioorg Med Chem 27: 3339-3346 (2019) Article DOI: 10.1016/j.bmc.2019.06.016 BindingDB Entry DOI: 10.7270/Q2DR2ZXC
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50522822 (CHEMBL4590868) Show SMILES Cc1ccc(CCC[N+]23CCC(CC2)C(C3)OC(=O)C(O)(c2ccccc2)c2ccccc2)cc1 Show InChI InChI=1S/C31H36NO3.BrH/c1-24-14-16-25(17-15-24)9-8-20-32-21-18-26(19-22-32)29(23-32)35-30(33)31(34,27-10-4-2-5-11-27)28-12-6-3-7-13-28;/h2-7,10-17,26,29,34H,8-9,18-23H2,1H3;1H/q+1;/p-1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.860	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Advanced Industrial Science and Technology (AIST) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M3R expressed in CHOK1 cell membranes incubated for 2 hrs by microbeta scintillation counting method				Bioorg Med Chem 27: 3339-3346 (2019) Article DOI: 10.1016/j.bmc.2019.06.016 BindingDB Entry DOI: 10.7270/Q2DR2ZXC
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50522814 (CHEMBL4461243) Show SMILES [Br-].OC(C(=O)OC1C[N+]2(CCCOc3ccccc3)CCC1CC2)(c1ccccc1)c1ccccc1 |(13.28,-19.41,;3.37,-21.2,;4.71,-21.98,;6.04,-22.74,;6.05,-24.28,;7.38,-21.97,;8.71,-22.74,;10.04,-21.96,;11.36,-22.74,;12.7,-21.97,;14.03,-22.74,;15.37,-21.97,;16.7,-22.75,;18.03,-21.98,;19.36,-22.76,;20.69,-21.99,;20.7,-20.45,;19.36,-19.68,;18.03,-20.45,;11.37,-24.28,;10.04,-25.04,;8.71,-24.28,;10.2,-24.07,;9.85,-23.02,;4.7,-20.44,;6.03,-19.67,;6.03,-18.13,;4.69,-17.36,;3.36,-18.14,;3.37,-19.68,;3.38,-22.75,;2.04,-21.98,;.71,-22.75,;.72,-24.29,;2.06,-25.06,;3.39,-24.28,)| Show InChI InChI=1S/C30H34NO4.BrH/c32-29(30(33,25-11-4-1-5-12-25)26-13-6-2-7-14-26)35-28-23-31(20-17-24(28)18-21-31)19-10-22-34-27-15-8-3-9-16-27;/h1-9,11-16,24,28,33H,10,17-23H2;1H/q+1;/p-1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.880	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Advanced Industrial Science and Technology (AIST) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M3R expressed in CHOK1 cell membranes incubated for 2 hrs by microbeta scintillation counting method				Bioorg Med Chem 27: 3339-3346 (2019) Article DOI: 10.1016/j.bmc.2019.06.016 BindingDB Entry DOI: 10.7270/Q2DR2ZXC
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM50375450 (CHEMBL407909 | YM-348) Show SMILES CCc1cc2c(ccc3cnn(C[C@H](C)N)c23)o1 Show InChI InChI=1S/C14H17N3O/c1-3-11-6-12-13(18-11)5-4-10-7-16-17(14(10)12)8-9(2)15/h4-7,9H,3,8,15H2,1-2H3/t9-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	0.890	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharma Inc. Curated by ChEMBL					Assay Description Displacement of [3H]5-HT from human 5HT2C receptor expressed in CHO cells				Bioorg Med Chem 16: 1966-82 (2008) Article DOI: 10.1016/j.bmc.2007.10.100 BindingDB Entry DOI: 10.7270/Q2TH8NKR
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM86441 (CAS_3045225 | NSC_3045225 | YM348) Show SMILES CCc1cc2c(ccc3cnn(CC(C)N)c23)o1 Show InChI InChI=1S/C14H17N3O/c1-3-11-6-12-13(18-11)5-4-10-7-16-17(14(10)12)8-9(2)15/h4-7,9H,3,8,15H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	0.890	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Yamanouchi Pharmaceutical Co., Ltd. Curated by PDSP Ki Database									Eur J Pharmacol 483: 37-43 (2004) Article DOI: 10.1016/j.ejphar.2003.10.004 BindingDB Entry DOI: 10.7270/Q2ZG6QTV
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM50375450 (CHEMBL407909 | YM-348) Show SMILES CCc1cc2c(ccc3cnn(C[C@H](C)N)c23)o1 Show InChI InChI=1S/C14H17N3O/c1-3-11-6-12-13(18-11)5-4-10-7-16-17(14(10)12)8-9(2)15/h4-7,9H,3,8,15H2,1-2H3/t9-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	0.890	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharma Inc. Curated by ChEMBL					Assay Description Displacement of [3H]5-HT from human 5HT2C receptor expressed in CHO cells				Bioorg Med Chem 16: 3309-20 (2008) Article DOI: 10.1016/j.bmc.2007.12.009 BindingDB Entry DOI: 10.7270/Q2PN96H0
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50522823 (CHEMBL4545504) Show SMILES COc1ccc(CCC[N+]23CCC(CC2)C(C3)OC(=O)C(O)(c2ccccc2)c2ccccc2)cc1 Show InChI InChI=1S/C31H36NO4.BrH/c1-35-28-16-14-24(15-17-28)9-8-20-32-21-18-25(19-22-32)29(23-32)36-30(33)31(34,26-10-4-2-5-11-26)27-12-6-3-7-13-27;/h2-7,10-17,25,29,34H,8-9,18-23H2,1H3;1H/q+1;/p-1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.910	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Advanced Industrial Science and Technology (AIST) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M2R expressed in CHOK1 cell membranes incubated for 2 hrs by microbeta scintillation counting method				Bioorg Med Chem 27: 3339-3346 (2019) Article DOI: 10.1016/j.bmc.2019.06.016 BindingDB Entry DOI: 10.7270/Q2DR2ZXC
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50522832 (CHEMBL4483083) Show SMILES [Br-].OC(C(=O)O[C@H]1C[N+]2(CCCc3ccccc3)CCC1CC2)(c1ccccc1)c1ccccc1 |r,wU:6.4,(82.97,-35.31,;73.57,-37.16,;74.91,-37.93,;76.24,-38.7,;76.25,-40.24,;77.57,-37.92,;78.91,-38.69,;80.24,-37.91,;81.56,-38.69,;82.9,-37.92,;84.23,-38.69,;85.56,-37.93,;86.9,-38.7,;86.89,-40.24,;88.22,-41.01,;89.56,-40.24,;89.56,-38.7,;88.22,-37.93,;81.57,-40.23,;80.24,-40.99,;78.91,-40.23,;80.4,-40.03,;80.05,-38.98,;74.9,-36.39,;76.23,-35.62,;76.23,-34.08,;74.89,-33.31,;73.56,-34.1,;73.57,-35.63,;73.57,-38.7,;72.24,-37.93,;70.91,-38.7,;70.91,-40.25,;72.26,-41.01,;73.58,-40.24,)| Show InChI InChI=1S/C30H34NO3.BrH/c32-29(30(33,26-14-6-2-7-15-26)27-16-8-3-9-17-27)34-28-23-31(21-18-25(28)19-22-31)20-10-13-24-11-4-1-5-12-24;/h1-9,11-12,14-17,25,28,33H,10,13,18-23H2;1H/q+1;/p-1/t25?,28-,31?;/m0./s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Advanced Industrial Science and Technology (AIST) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M2R expressed in CHOK1 cell membranes incubated for 2 hrs by microbeta scintillation counting method				Bioorg Med Chem 27: 3339-3346 (2019) Article DOI: 10.1016/j.bmc.2019.06.016 BindingDB Entry DOI: 10.7270/Q2DR2ZXC
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50522818 (CHEMBL4436930) Show SMILES [Br-].OC(C(=O)OC1C[N+]2(CCCc3cccc(F)c3)CCC1CC2)(c1ccccc1)c1ccccc1 |(60.41,-49.31,;51.01,-51.16,;52.35,-51.94,;53.68,-52.7,;53.69,-54.24,;55.02,-51.93,;56.35,-52.7,;57.68,-51.92,;59,-52.7,;60.34,-51.93,;61.67,-52.7,;63.01,-51.93,;64.34,-52.71,;65.67,-51.94,;67,-52.7,;67,-54.25,;65.66,-55.02,;65.66,-56.56,;64.33,-54.25,;59.01,-54.24,;57.68,-55,;56.35,-54.24,;57.84,-54.03,;57.49,-52.98,;52.34,-50.4,;53.67,-49.63,;53.67,-48.09,;52.33,-47.32,;51,-48.1,;51.01,-49.64,;51.02,-52.71,;49.68,-51.94,;48.35,-52.71,;48.36,-54.25,;49.7,-55.02,;51.03,-54.24,)| Show InChI InChI=1S/C30H33FNO3.BrH/c31-27-15-7-9-23(21-27)10-8-18-32-19-16-24(17-20-32)28(22-32)35-29(33)30(34,25-11-3-1-4-12-25)26-13-5-2-6-14-26;/h1-7,9,11-15,21,24,28,34H,8,10,16-20,22H2;1H/q+1;/p-1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Advanced Industrial Science and Technology (AIST) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M3R expressed in CHOK1 cell membranes incubated for 2 hrs by microbeta scintillation counting method				Bioorg Med Chem 27: 3339-3346 (2019) Article DOI: 10.1016/j.bmc.2019.06.016 BindingDB Entry DOI: 10.7270/Q2DR2ZXC
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50522822 (CHEMBL4590868) Show SMILES Cc1ccc(CCC[N+]23CCC(CC2)C(C3)OC(=O)C(O)(c2ccccc2)c2ccccc2)cc1 Show InChI InChI=1S/C31H36NO3.BrH/c1-24-14-16-25(17-15-24)9-8-20-32-21-18-26(19-22-32)29(23-32)35-30(33)31(34,27-10-4-2-5-11-27)28-12-6-3-7-13-28;/h2-7,10-17,26,29,34H,8-9,18-23H2,1H3;1H/q+1;/p-1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Advanced Industrial Science and Technology (AIST) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M2R expressed in CHOK1 cell membranes incubated for 2 hrs by microbeta scintillation counting method				Bioorg Med Chem 27: 3339-3346 (2019) Article DOI: 10.1016/j.bmc.2019.06.016 BindingDB Entry DOI: 10.7270/Q2DR2ZXC
					More data for this Ligand-Target Pair
Protein kinase C epsilon type (Homo sapiens (Human))	BDBM50327943 (Aplysiatoxin | CHEMBL1256416) Show SMILES CO[C@@H](CC[C@H](C)[C@H]1O[C@@]23C[C@H](OC(=O)C[C@@H](OC(=O)C[C@](O)(O2)[C@H](C)CC3(C)C)[C@@H](C)O)[C@@H]1C)c1cc(O)ccc1Br |r| Show InChI InChI=1S/C32H47BrO10/c1-17(8-11-24(39-7)22-12-21(35)9-10-23(22)33)29-19(3)26-15-32(42-29)30(5,6)14-18(2)31(38,43-32)16-28(37)40-25(20(4)34)13-27(36)41-26/h9-10,12,17-20,24-26,29,34-35,38H,8,11,13-16H2,1-7H3/t17-,18+,19-,20+,24-,25+,26?,29+,31-,32-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	1.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Inhibition of [3H]PDBu binding to PKCepsilon C1B peptide				Bioorg Med Chem Lett 20: 6064-6 (2010) Article DOI: 10.1016/j.bmcl.2010.08.051 BindingDB Entry DOI: 10.7270/Q2FJ2H04
					More data for this Ligand-Target Pair
Protein kinase C delta type (Homo sapiens (Human))	BDBM50491400 (CHEMBL2381165) Show SMILES [H][C@@]12CCC(C)(C)[C@]3(C[C@@]([H])(C[C@@H](CCCCc4ccc(I)c(O)c4)O3)OC(=O)C[C@H](CO)OC(=O)C1)O2 |r| Show InChI InChI=1S/C27H37IO8/c1-26(2)10-9-19-13-24(31)34-21(16-29)14-25(32)33-20-12-18(35-27(26,15-20)36-19)6-4-3-5-17-7-8-22(28)23(30)11-17/h7-8,11,18-21,29-30H,3-6,9-10,12-16H2,1-2H3/t18-,19-,20-,21-,27+/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Inhibition of [3H]PDBu binding to PKCdelta-C1B domain peptide (unknown origin)				Bioorg Med Chem 21: 2695-702 (2013) Article DOI: 10.1016/j.bmc.2013.03.013 BindingDB Entry DOI: 10.7270/Q26M39RD
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM50375458 (CHEMBL406851) Show SMILES C[C@H](N)Cn1ncc2ccc3sccc3c12 Show InChI InChI=1S/C12H13N3S/c1-8(13)7-15-12-9(6-14-15)2-3-11-10(12)4-5-16-11/h2-6,8H,7,13H2,1H3/t8-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	1.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharma Inc. Curated by ChEMBL					Assay Description Displacement of [3H]5-HT from human 5HT2C receptor expressed in CHO cells				Bioorg Med Chem 16: 1966-82 (2008) Article DOI: 10.1016/j.bmc.2007.10.100 BindingDB Entry DOI: 10.7270/Q2TH8NKR
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50522820 (CHEMBL4463636) Show SMILES Cc1cccc(CCC[N+]23CCC(CC2)C(C3)OC(=O)C(O)(c2ccccc2)c2ccccc2)c1 Show InChI InChI=1S/C31H36NO3.BrH/c1-24-10-8-11-25(22-24)12-9-19-32-20-17-26(18-21-32)29(23-32)35-30(33)31(34,27-13-4-2-5-14-27)28-15-6-3-7-16-28;/h2-8,10-11,13-16,22,26,29,34H,9,12,17-21,23H2,1H3;1H/q+1;/p-1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Advanced Industrial Science and Technology (AIST) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M2R expressed in CHOK1 cell membranes incubated for 2 hrs by microbeta scintillation counting method				Bioorg Med Chem 27: 3339-3346 (2019) Article DOI: 10.1016/j.bmc.2019.06.016 BindingDB Entry DOI: 10.7270/Q2DR2ZXC
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50522824 (CHEMBL4521993) Show SMILES [Br-].OC(C(=O)OC1C[N+]2(CCCc3ccc(OC(F)(F)F)cc3)CCC1CC2)(c1ccccc1)c1ccccc1 |(60.52,-35.48,;50.59,-37.33,;51.93,-38.1,;53.27,-38.87,;53.27,-40.41,;54.6,-38.09,;55.93,-38.86,;57.26,-38.08,;58.59,-38.86,;59.92,-38.09,;61.25,-38.86,;62.59,-38.1,;63.92,-38.87,;63.91,-40.41,;65.24,-41.18,;66.58,-40.41,;67.91,-41.19,;67.91,-42.73,;69.25,-43.5,;66.58,-43.49,;67.9,-44.27,;66.58,-38.87,;65.25,-38.1,;58.59,-40.4,;57.26,-41.16,;55.93,-40.4,;57.43,-40.2,;57.08,-39.15,;51.92,-36.56,;53.26,-35.79,;53.25,-34.25,;51.92,-33.48,;50.58,-34.27,;50.59,-35.8,;50.6,-38.88,;49.26,-38.1,;47.93,-38.88,;47.94,-40.42,;49.28,-41.18,;50.61,-40.41,)| Show InChI InChI=1S/C31H33F3NO4.BrH/c32-31(33,34)39-27-15-13-23(14-16-27)8-7-19-35-20-17-24(18-21-35)28(22-35)38-29(36)30(37,25-9-3-1-4-10-25)26-11-5-2-6-12-26;/h1-6,9-16,24,28,37H,7-8,17-22H2;1H/q+1;/p-1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Advanced Industrial Science and Technology (AIST) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M3R expressed in CHOK1 cell membranes incubated for 2 hrs by microbeta scintillation counting method				Bioorg Med Chem 27: 3339-3346 (2019) Article DOI: 10.1016/j.bmc.2019.06.016 BindingDB Entry DOI: 10.7270/Q2DR2ZXC
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50417445 (AHR-504 | CUVPOSA | GLYCOPYRROLATE) Show SMILES C[N+]1(C)CCC(C1)OC(=O)C(O)(C1CCCC1)c1ccccc1 Show InChI InChI=1S/C19H28NO3/c1-20(2)13-12-17(14-20)23-18(21)19(22,16-10-6-7-11-16)15-8-4-3-5-9-15/h3-5,8-9,16-17,22H,6-7,10-14H2,1-2H3/q+1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase DrugBank MCE PC cid PC sid UniChem Similars	Article PubMed	1.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Advanced Industrial Science and Technology (AIST) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M2R expressed in CHOK1 cell membranes incubated for 2 hrs by microbeta scintillation counting method				Bioorg Med Chem 27: 3339-3346 (2019) Article DOI: 10.1016/j.bmc.2019.06.016 BindingDB Entry DOI: 10.7270/Q2DR2ZXC
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50522813 (CHEMBL4539799) Show SMILES [Br-].OC(C(=O)OC1C[N+]2(CCCc3ccc(Br)cc3)CCC1CC2)(c1ccccc1)c1ccccc1 |(60.03,-19.13,;50.39,-21.97,;51.73,-22.75,;53.06,-23.51,;53.07,-25.05,;54.39,-22.74,;55.73,-23.51,;57.06,-22.73,;58.38,-23.51,;59.72,-22.74,;61.05,-23.51,;62.38,-22.74,;63.72,-23.52,;63.71,-25.05,;65.04,-25.83,;66.38,-25.06,;67.71,-25.83,;66.37,-23.51,;65.04,-22.75,;58.39,-25.05,;57.06,-25.81,;55.73,-25.05,;57.22,-24.84,;56.87,-23.79,;51.72,-21.21,;53.05,-20.44,;53.05,-18.9,;51.71,-18.13,;50.38,-18.91,;50.39,-20.45,;50.39,-23.52,;49.06,-22.75,;47.73,-23.52,;47.73,-25.06,;49.08,-25.83,;50.4,-25.05,)| Show InChI InChI=1S/C30H33BrNO3.BrH/c31-27-15-13-23(14-16-27)8-7-19-32-20-17-24(18-21-32)28(22-32)35-29(33)30(34,25-9-3-1-4-10-25)26-11-5-2-6-12-26;/h1-6,9-16,24,28,34H,7-8,17-22H2;1H/q+1;/p-1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Advanced Industrial Science and Technology (AIST) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M2R expressed in CHOK1 cell membranes incubated for 2 hrs by microbeta scintillation counting method				Bioorg Med Chem 27: 3339-3346 (2019) Article DOI: 10.1016/j.bmc.2019.06.016 BindingDB Entry DOI: 10.7270/Q2DR2ZXC
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50522821 (CHEMBL4450188) Show SMILES [Br-].OC(C(=O)OC1C[N+]2(CCCc3ccc(F)cc3)CCC1CC2)(c1ccccc1)c1ccccc1 |(13.36,-19.18,;4.01,-20.28,;5.35,-21.05,;6.68,-21.82,;6.69,-23.36,;8.01,-21.04,;9.35,-21.81,;10.68,-21.03,;12,-21.81,;13.34,-21.04,;14.67,-21.82,;16,-21.05,;17.34,-21.82,;17.33,-23.36,;18.66,-24.13,;20,-23.36,;21.33,-24.14,;20,-21.82,;18.66,-21.05,;12.01,-23.35,;10.68,-24.11,;9.35,-23.35,;10.84,-23.15,;10.49,-22.1,;5.34,-19.51,;6.67,-18.74,;6.67,-17.2,;5.33,-16.43,;4,-17.22,;4.01,-18.75,;4.01,-21.83,;2.68,-21.05,;1.35,-21.83,;1.35,-23.37,;2.7,-24.13,;4.02,-23.36,)| Show InChI InChI=1S/C30H33FNO3.BrH/c31-27-15-13-23(14-16-27)8-7-19-32-20-17-24(18-21-32)28(22-32)35-29(33)30(34,25-9-3-1-4-10-25)26-11-5-2-6-12-26;/h1-6,9-16,24,28,34H,7-8,17-22H2;1H/q+1;/p-1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Advanced Industrial Science and Technology (AIST) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M3R expressed in CHOK1 cell membranes incubated for 2 hrs by microbeta scintillation counting method				Bioorg Med Chem 27: 3339-3346 (2019) Article DOI: 10.1016/j.bmc.2019.06.016 BindingDB Entry DOI: 10.7270/Q2DR2ZXC
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50522820 (CHEMBL4463636) Show SMILES Cc1cccc(CCC[N+]23CCC(CC2)C(C3)OC(=O)C(O)(c2ccccc2)c2ccccc2)c1 Show InChI InChI=1S/C31H36NO3.BrH/c1-24-10-8-11-25(22-24)12-9-19-32-20-17-26(18-21-32)29(23-32)35-30(33)31(34,27-13-4-2-5-14-27)28-15-6-3-7-16-28;/h2-8,10-11,13-16,22,26,29,34H,9,12,17-21,23H2,1H3;1H/q+1;/p-1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Advanced Industrial Science and Technology (AIST) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M3R expressed in CHOK1 cell membranes incubated for 2 hrs by microbeta scintillation counting method				Bioorg Med Chem 27: 3339-3346 (2019) Article DOI: 10.1016/j.bmc.2019.06.016 BindingDB Entry DOI: 10.7270/Q2DR2ZXC
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50377964 (Cantil | Glycophenylate | MEPENZOLATE BROMIDE | Me...) Show SMILES C[N+]1(C)CCCC(C1)OC(=O)C(O)(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C21H26NO3/c1-22(2)15-9-14-19(16-22)25-20(23)21(24,17-10-5-3-6-11-17)18-12-7-4-8-13-18/h3-8,10-13,19,24H,9,14-16H2,1-2H3/q+1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase DrugBank PC cid PC sid UniChem Similars	Article PubMed	2.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Advanced Industrial Science and Technology (AIST) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M2R expressed in CHOK1 cell membranes incubated for 2 hrs by microbeta scintillation counting method				Bioorg Med Chem 27: 3339-3346 (2019) Article DOI: 10.1016/j.bmc.2019.06.016 BindingDB Entry DOI: 10.7270/Q2DR2ZXC
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50522819 (CHEMBL4452706) Show SMILES OC(C(=O)OC1C[N+]2(CCCc3cccc(Cl)c3)CCC1CC2)(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C30H33ClNO3.BrH/c31-27-15-7-9-23(21-27)10-8-18-32-19-16-24(17-20-32)28(22-32)35-29(33)30(34,25-11-3-1-4-12-25)26-13-5-2-6-14-26;/h1-7,9,11-15,21,24,28,34H,8,10,16-20,22H2;1H/q+1;/p-1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Advanced Industrial Science and Technology (AIST) Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human M2R expressed in CHOK1 cell membranes incubated for 2 hrs by microbeta scintillation counting method				Bioorg Med Chem 27: 3339-3346 (2019) Article DOI: 10.1016/j.bmc.2019.06.016 BindingDB Entry DOI: 10.7270/Q2DR2ZXC
					More data for this Ligand-Target Pair

Displayed 1 to 50 (of 1726 total )  |  Next  |  Last  >>

Jump to: