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TargetNeuronal acetylcholine receptor subunit alpha-3/beta-4
LigandBDBM50446508
Substrate/Competitorn/a
Meas. Tech.ChEMBL_1287913 (CHEMBL3112332)
Ki 23765±n/a nM
Citation Wu, JZhang, YMaida, LESantos, RGWelmaker, GSLaVoi, TMNefzi, AYu, YHoughten, RAToll, LGiulianotti, MA Scaffold ranking and positional scanning utilized in the discovery of nAChR-selective compounds suitable for optimization studies. J Med Chem56:10103-17 (2013) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Neuronal acetylcholine receptor subunit alpha-3/beta-4
Name:Neuronal acetylcholine receptor subunit alpha-3/beta-4
Synonyms:Neuronal acetylcholine receptor Alpha-3/Beta-4 | Neuronal acetylcholine receptor protein alpha-3/beta-4 subunit | Neuronal acetylcholine receptor; alpha3/beta4 | nAChR subtypes alpha3 beta4
Type:Protein
Mol. Mass.:n/a
Description:n/a
Components:This complex has 2 components.
Component 1
Name:Neuronal acetylcholine receptor subunit alpha-3
Synonyms:ACHA3_RAT | Acra3 | Chrna3
Type:Enzyme
Mol. Mass.:56995.52
Organism:Rattus norvegicus (Rat)
Description:P04757
Residue:499
Sequence:
MGVVLLPPPLSMLMLVLMLLPAASASEAEHRLFQYLFEDYNEIIRPVANVSHPVIIQFEV
SMSQLVKVDEVNQIMETNLWLKQIWNDYKLKWKPSDYQGVEFMRVPAEKIWKPDIVLYNN
ADGDFQVDDKTKALLKYTGEVTWIPPAIFKSSCKIDVTYFPFDYQNCTMKFGSWSYDKAK
IDLVLIGSSMNLKDYWESGEWAIIKAPGYKHEIKYNCCEEIYQDITYSLYIRRLPLFYTI
NLIIPCLLISFLTVLVFYLPSDCGEKVTLCISVLLSLTVFLLVITETIPSTSLVIPLIGE
YLLFTMIFVTLSIVITVFVLNVHYRTPTTHTMPTWVKAVFLNLLPRVMFMTRPTSGEGDT
PKTRTFYGAELSNLNCFSRADSKSCKEGYPCQDGTCGYCHHRRVKISNFSANLTRSSSSE
SVNAVLSLSALSPEIKEAIQSVKYIAENMKAQNVAKEIQDDWKYVAMVIDRIFLWVFILV
CILGTAGLFLQPLMARDDT
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Component 2
Name:Neuronal acetylcholine receptor subunit beta-4
Synonyms:ACHB4_RAT | Acrb4 | Chrnb4 | N-alpha 2 | Neuronal acetylcholine receptor non-alpha-2 chain | Neuronal acetylcholine receptor protein beta-4 subunit
Type:Enzyme
Mol. Mass.:55863.89
Organism:Rattus norvegicus (Rat)
Description:P12392
Residue:495
Sequence:
MRGTPLLLVSLFSLLQDGDCRLANAEEKLMDDLLNKTRYNNLIRPATSSSQLISIRLELS
LSQLISVNEREQIMTTSIWLKQEWTDYRLAWNSSCYEGVNILRIPAKRVWLPDIVLYNNA
DGTYEVSVYTNVIVRSNGSIQWLPPAIYKSACKIEVKHFPFDQQNCTLKFRSWTYDHTEI
DMVLKSPTAIMDDFTPSGEWDIVALPGRRTVNPQDPSYVDVTYDFIIKRKPLFYTINLII
PCVLITSLAILVFYLPSDCGEKMTLCISVLLALTFFLLLISKIVPPTSLDIPLIGKYLLF
TMVLVTFSIVTTVCVLNVHHRSPSTHTMASWVKECFLHKLPTFLFMKRPGLEVSLVRVPH
PSQLHLATADTAATSALGPTSPSNLYGSSMYFVNPVPAAPKSAVSSHTAGLPRDARLRSS
GRFREDLQEALEGVSFIAQHLESDDRDQSVIEDWKFVAMVVDRLFLWVFVFVCILGTMGL
FLPPLFQIHAPSKDS
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BDBM50446508
n/a
NameBDBM50446508
Synonyms:CHEMBL3110044
TypeSmall organic molecule
Emp. Form.C35H53N7
Mol. Mass.571.8422
SMILESCC(C)(C)C1CCC(CN2[C@@H](Cc3ccccc3)CN(CCCC[C@H]3CN=C(N)N3CCc3cccnc3)C2=N)CC1 |r,wU:10.10,24.24,t:27,(41.24,-2.68,;40.53,-4.04,;38.99,-4.1,;39.74,-2.7,;41.35,-5.35,;42.88,-5.29,;43.7,-6.58,;42.98,-7.94,;43.81,-9.23,;43.13,-10.63,;44.06,-11.86,;45.6,-11.83,;46.35,-10.49,;45.56,-9.17,;46.3,-7.83,;47.85,-7.8,;48.63,-9.13,;47.89,-10.47,;43.17,-13.12,;41.7,-12.66,;40.36,-13.42,;39.03,-12.64,;37.69,-13.39,;36.36,-12.6,;35.02,-13.36,;35.04,-14.9,;33.58,-15.39,;32.66,-14.15,;31.12,-14.17,;33.55,-12.9,;32.85,-11.53,;31.3,-11.46,;30.52,-10.13,;31.28,-8.79,;30.5,-7.47,;28.96,-7.48,;28.2,-8.82,;28.99,-10.14,;41.67,-11.12,;40.42,-10.24,;41.45,-8.01,;40.63,-6.71,)|
Structure
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