Reaction Details Report a problem with these data
Target
Potassium voltage-gated channel subfamily A member 1
Ligand
BDBM50237249
Substrate
n/a
Meas. Tech.
ChEMBL_1659945 (CHEMBL4009557)
IC50
13000±n/a nM
Citation
 Al-Sabi, A; Daly, D; Hoefer, P; Kinsella, GK; Metais, C; Pickering, M; Herron, C; Kaza, SK; Nolan, K; Dolly, JO A Rational Design of a Selective Inhibitor for Kv1.1 Channels Prevalent in Demyelinated Nerves That Improves Their Impaired Axonal Conduction. J Med Chem 60:2245-2256 (2017) [PubMed]  Article 
Target
Name:
Potassium voltage-gated channel subfamily A member 1
Synonyms:
KCNA1_RAT | Kcna1 | Potassium voltage-gated channel subfamily A member 1 | RBKI | RCK1 | Voltage-gated potassium channel subunit Kv1.1
Type:
PROTEIN
Mol. Mass.:
56364.13
Organism:
Rattus norvegicus
Description:
ChEMBL_117743
Residue:
495
Sequence:
MTVMSGENADEASAAPGHPQDGSYPRQADHDDHECCERVVINISGLRFETQLKTLAQFPNTLLGNPKKRMRYFDPLRNEYFFDRNRPSFDAILYYYQSGGRLRRPVNVPLDMFSEEIKFYELGEEAMEKFREDEGFIKEEERPLPEKEYQRQVWLLFEYPESSGPARVIAIVSVMVILISIVIFCLETLPELKDDKDFTGTIHRIDNTTVIYTSNIFTDPFFIVETLCIIWFSFELVVRFFACPSKTDFFKNIMNFIDIVAIIPYFITLGTEIAEQEGNQKGEQATSLAILRVIRLVRVFRIFKLSRHSKGLQILGQTLKASMRELGLLIFFLFIGVILFSSAVYFAEAEEAESHFSSIPDAFWWAVVSMTTVGYGDMYPVTIGGKIVGSLCAIAGVLTIALPVPVIVSNFNYFYHRETEGEEQAQLLHVSSPNLASDSDLSRRSSSTISKSEYMEIEEDMNNSIAHYRQANIRTGNCTATDQNCVNKSKLLTDV
  
Inhibitor
Name:
BDBM50237249
Synonyms:
CHEMBL4076021
Type:
Small organic molecule
Emp. Form.:
C76H86N12O12
Mol. Mass.:
1359.5692
SMILES:
CC(C)(C)OC(=O)NCCNC(=O)c1ccc(cc1)-c1c2ccc(n2)c(-c2ccc(cc2)C(=O)NCCNC(=O)OC(C)(C)C)c2ccc([nH]2)c(-c2ccc(cc2)C(=O)NCCNC(=O)OC(C)(C)C)c2ccc(n2)c(-c2ccc(cc2)C(=O)NCCNC(=O)OC(C)(C)C)c2ccc1[nH]2
Structure:
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