72 complex(es)
PDB ID
Protein Name
Organism
Uniprot ID/ACC
Ligand Name
HET ID
Structure
PS-Score (Pocket Similarity)
Card
1 6NP0 5-hydroxytryptamine receptor 3A Mus musculus P23979 (5HT3A_MOUSE) 1-methyl-N-[(1R,5S)-9-methyl-9-azabicyclo[3.3.1]nonan-3-yl]indazole-3-carboxamide CWB 0.86 SHOW
2 6HIS 5-hydroxytryptamine receptor 3A Mus musculus P23979 (5HT3A_MOUSE) (3-ENDO)-8-METHYL-8-AZABICYCLO[3.2.1]OCT-3-YL 1H-INDOLE-3-CARBOXYLATE TKT 0.8 SHOW
3 5O8T Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) STRYCHNINE SY9 0.54 SHOW
4 5OAJ Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) (3-ENDO)-8-METHYL-8-AZABICYCLO[3.2.1]OCT-3-YL 1H-INDOLE-3-CARBOXYLATE TKT 0.53 SHOW
5 5OBH Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) (5S)-6,6-dimethyl-5-[(6R)-8-oxo-6,8-dihydrofuro[3,4-e][1,3]benzodioxol-6-yl]-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-6-ium J94 0.53 SHOW
6 5OAL Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) STRYCHNINE SY9 0.52 SHOW
7 2WNC Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) (3-ENDO)-8-METHYL-8-AZABICYCLO[3.2.1]OCT-3-YL 1H-INDOLE-3-CARBOXYLATE TKT 0.5 SHOW
8 2YME Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) 1-methyl-N-[(1R,5S)-9-methyl-9-azabicyclo[3.3.1]nonan-3-yl]indazole-3-carboxamide CWB 0.5 SHOW
9 5Y2Q Acetylcholine-binding protein Lymnaea stagnalis P58154 (ACHP_LYMST) 3-[[4-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]methoxy]pyridine 8L3 0.5 SHOW
10 2XZ5 Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) ACETYLCHOLINE ACH 0.5 SHOW
11 4BQT Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) (1R,5S)-1,2,3,4,5,6-HEXAHYDRO-8H-1,5-METHANOPYRIDO[1,2-A][1,5]DIAZOCIN-8-ONE C5E 0.5 SHOW
12 5O87 Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) (S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE NCT 0.49 SHOW
13 5OA0 Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) STRYCHNINE SY9 0.49 SHOW
14 6SH0 Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) 1-[(1R,6R)-9-azabicyclo[4.2.1]non-2-en-2-yl]ethanone 4P0 0.49 SHOW
15 5BRX Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) (2R,3S,5R,7S)-2-(pyridin-3-yl)-1-azatricyclo[3.3.1.1~3,7~]decane TI4 0.49 SHOW
16 5SYO Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) (1R,5S)-1,2,3,4,5,6-HEXAHYDRO-8H-1,5-METHANOPYRIDO[1,2-A][1,5]DIAZOCIN-8-ONE C5E 0.48 SHOW
17 1UV6 Acetylcholine-binding protein Lymnaea stagnalis P58154 (ACHP_LYMST) 2-[(AMINOCARBONYL)OXY]-N,N,N-TRIMETHYLETHANAMINIUM CCE 0.47 SHOW
18 5AIN Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) VARENICLINE QMR 0.47 SHOW
19 4ZK4 Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) (5R)-1-methyl-7-[5-(propan-2-yloxy)pyridin-3-yl]-1,7-diazaspiro[4.4]nonane TII 0.47 SHOW
20 3WIP Acetylcholine-binding protein Lymnaea stagnalis P58154 (ACHP_LYMST) ACETYLCHOLINE ACH 0.47 SHOW
21 3RQW Gamma-aminobutyric-acid receptor subunit beta-1 Dickeya dadantii E0SJQ4 (E0SJQ4_DICD3) ACETYLCHOLINE ACH 0.47 SHOW
22 2XNU Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) 2-(2-(4-PHENYLPIPERIDIN-1-YL)ETHYL)-1H-INDOLE VU3 0.47 SHOW
23 6SGV Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) Hosieine LDQ 0.47 SHOW
24 5BP0 Acetylcholine-binding protein Lymnaea stagnalis P58154 (ACHP_LYMST) 5-fluoronicotine FN1 0.47 SHOW
25 2XYS Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) STRYCHNINE SY9 0.47 SHOW
26 1UW6 Acetylcholine-binding protein Lymnaea stagnalis P58154 (ACHP_LYMST) (S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE NCT 0.47 SHOW
27 3U8L Acetylcholine-binding protein Lymnaea stagnalis P58154 (ACHP_LYMST) 1-(5-phenylpyridin-3-yl)-1,4-diazepane 09Q 0.47 SHOW
28 4WV9 Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) (3-exo)-8,8-dimethyl-3-[4-(pyridin-4-yl)-1H-1,2,3-triazol-1-yl]-8-azoniabicyclo[3.2.1]octane MD4 0.46 SHOW
29 5TVC Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) (E,2S)-N-methyl-5-(5-phenoxy-3-pyridyl)pent-4-en-2-amine 7LB 0.46 SHOW
30 4AFT Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) VARENICLINE QMR 0.46 SHOW
31 4AFG Achbp Capitella teleta I6L8L2 (I6L8L2_CAPTE) VARENICLINE QMR 0.45 SHOW
32 4UM1 Acetylcholine-binding protein Lymnaea stagnalis P58154 (ACHP_LYMST) 1-(5-ethoxypyridin-3-yl)-1,4-diazepane 09P 0.45 SHOW
33 5KXI Neuronal acetylcholine receptor subunit alpha4beta-2 Homo sapiens P17787 (ACHB2_HUMAN) (S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE NCT 0.45 SHOW
34 3ZDG Acetylcholine-binding protein Lymnaea stagnalis P58154 (ACHP_LYMST) 3-(dimethylamino)butyl dimethylcarbamate XRX 0.45 SHOW
35 5BW2 Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) (2R)-2-(pyridin-3-yl)-1-azabicyclo[2.2.2]octane 4VU 0.45 SHOW
36 4UM3 Acetylcholine-binding protein Lymnaea stagnalis P58154 (ACHP_LYMST) 1-(6-bromopyridin-3-yl)-1,4-diazepane 09R 0.44 SHOW
37 6PUF Major histocompatibility complex class I-related gene protein Homo sapiens Q95460 (HMR1_HUMAN) 1-deoxy-1-({2,6-dioxo-5-[(E)-(2-oxopropylidene)amino]-1,2,3,6-tetrahydropyrimidin-4-yl}amino)-D-ribitol 2LJ 0.44 SHOW
38 6QKK Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) 4-[5-[(1~{R},2~{R},4~{S})-7-azabicyclo[2.2.1]heptan-2-yl]-2-fluoranyl-pyridin-3-yl]benzamide H92 0.44 SHOW
39 6CNK Neuronal acetylcholine receptor subunit alpha4beta-2 Homo sapiens P17787 (ACHB2_HUMAN) (S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE NCT 0.44 SHOW
40 6QQP Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) 2-[5-[(1~{R},2~{R},4~{S})-7-azabicyclo[2.2.1]heptan-2-yl]-2-fluoranyl-pyridin-3-yl]pyridine-4-carboxamide JCW 0.44 SHOW
41 5AFK Acetylcholine-binding protein Lymnaea stagnalis P58154 (ACHP_LYMST) Alpha-Lobeline L0B 0.44 SHOW
42 3WTO Acetylcholine-binding protein Lymnaea stagnalis P58154 (ACHP_LYMST) (2Z)-1-[(6-chloropyridin-3-yl)methyl]imidazolidin-2-imine N2Y 0.44 SHOW
43 4ZRU Acetylcholine-binding protein Lymnaea stagnalis P58154 (ACHP_LYMST) 3-[(2S)-pyrrolidin-2-ylethynyl]pyridine TI9 0.43 SHOW
44 5FJV Neuronal acetylcholine receptor subunit alpha-2 Homo sapiens Q15822 (ACHA2_HUMAN) EPIBATIDINE EPJ 0.43 SHOW
45 2BYQ Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) EPIBATIDINE EPJ 0.43 SHOW
46 5KZU Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) 9-[[1-[8-methyl-8-(2-phenylethyl)-8-azoniabicyclo[3.2.1]octan-3-yl]triazol-4-yl]methyl]carbazole 74S 0.43 SHOW
47 4FRR Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) 3-[(2S)-azetidin-2-ylmethoxy]-5-[(1S,2R)-2-(2-methoxyethyl)cyclopropyl]pyridine 0VC 0.43 SHOW
48 2YMD Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) SEROTONIN SRO 0.43 SHOW
49 5LXB Soluble acetylcholine receptor Aplysia californica Q8WSF8 (Q8WSF8_APLCA) palonosetron 7A9 0.43 SHOW
50 5AFH Acetylcholine-binding protein Lymnaea stagnalis P58154 (ACHP_LYMST) Alpha-Lobeline L0B 0.43 SHOW