Reaction Details Report a problem with these data
Target
Voltage-dependent calcium channel alpha-2 delta subunit
Ligand
BDBM50080153
Substrate
n/a
Meas. Tech.
ChEMBL_348644 (CHEMBL866258)
IC50
70±n/a nM
Citation
 Burgos-Lepley, CE; Thompson, LR; Kneen, CO; Osborne, SA; Bryans, JS; Capiris, T; Suman-Chauhan, N; Dooley, DJ; Donovan, CM; Field, MJ; Vartanian, MG; Kinsora, JJ; Lotarski, SM; El-Kattan, A; Walters, K; Cherukury, M; Taylor, CP; Wustrow, DJ; Schwarz, JB Carboxylate bioisosteres of gabapentin. Bioorg Med Chem Lett 16:2333-6 (2006) [PubMed]  Article 
Target
Name:
Voltage-dependent calcium channel alpha-2 delta subunit
Synonyms:
Voltage-dependent calcium channel alpha2delta subunit
Type:
PROTEIN
Mol. Mass.:
123127.66
Organism:
Sus scrofa
Description:
ChEMBL_605546
Residue:
1091
Sequence:
MAAGCLLALTLTLFQSLLIGPSSQEPFPSAVTIKSWVDKMQEDLVTLAKTASGVNQLVDIYEKYQDLYTVEPNNARQLVEIAARDIEKLLSNRSKALVRLALEAEKVQAAHQWREDFASNEVVYYNAKDDLDPEKNDSEPGSQRIKPVFIDDANFGRQISYQHAAVHIPTDIYEGSTIVLNELNWTSALDEVFKKNREEDPSLLWQVFGSATGLARYYPASPWVDNSRTPNKIDLYDVRRRPWYIQGAASPKDMLILVDVSGSVSGLTLKLIRTSVSEMLETLSDDDFVNVASFNSNAQDVSCFQHLVQANVRNKKVLKDAVNNITAKGITDYKKGFSFAFEQLLNYNVSRANCNKIIMLFTDGGEERAQEIFAKYNKDKKVRVFTFSVGQHNYDRGPIQWMACENKGYYYEIPSIGAIRINTQEYLDVLGRPMVLAGDKAKQVQWTNVYLDALELGLVITGTLPVFNITGQNENKTNLKNQLILGVMGVDVSLEDIKRLTPRFTLCPNGYYFAIDPNGYVLLHPNLQPKNPKSQEPVTLDFLDAELENDIKVEIRNKMIDGESGEKTFRTLVKSQDERYIDKGNRTYTWTPVNGTDYSLALVLPTYSFYYIKAKIEETITQARSKKGKMKDSETLKPDNFEESGYTFIAPRDYCNDLKISDNNTEFLLNFNEFIDRKTPNNPSCNTDLINRVLLDAGFTNELVQNYWSKQKNIKGVKARFVVTDGGITRVYPKEAGENWQENPETYEDSFYKRSLDNDNYVFTAPYFNKSGPGAYESGIMVSKAVEIYIQGKLLKPAVVGIKIDVNSWIENFTKTSIRDPCAGPVCDCKRNSDVMDCVILDDGGFLLMANHDDYTNQIGRFFGEIDPSLMRHLVNISVYAFNKSYDYQSVCEPGAAPKQGAGHRSAYVPSIADILHIGWWATAAAWSILQQFLLSLTFPRLLEAVEMEDDDFTASLSKQSCITEQTQYFFDNDSKSFSGVLDCGNCSRIFHVEKLMNTNLIFIMVESKGTCPCDTRLLIQAEQTSDGPDPCDMVKQPRYRKGPDVCFDNNALEDYTDCGGVSGLNPSLWSIFGIQCVLLWLLSGSRHYQL
  
Inhibitor
Name:
BDBM50080153
Synonyms:
(1-Aminomethyl-cyclohexyl)-acetic acid | 2-(1-(aminomethyl)cyclohexyl)acetic acid | CHEMBL940 | CI-945 | GABAPENTIN | GOE-3450 | Neurontin | [1-(AMINOMETHYL)CYCLOHEXYL]ACETIC ACID
Type:
Small organic molecule
Emp. Form.:
C9H17NO2
Mol. Mass.:
171.2368
SMILES:
NCC1(CC(O)=O)CCCCC1
Structure:
Search PDB for entries with ligand similarity: