Reaction Details
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Report a problem with these dataTarget
Mu-type opioid receptor
Ligand
BDBM50135220
Substrate
n/a
Meas. Tech.
ChEMBL_1546048 (CHEMBL3748891)
Ki
263±n/a nM
Citation
Schembri, LS; Stoddart, LA; Briddon, SJ; Kellam, B; Canals, M; Graham, B; Scammells, PJ Synthesis, Biological Evaluation, and Utility of Fluorescent Ligands Targeting theľ-Opioid Receptor. J Med Chem 58:9754-67 (2015) [PubMed] Article More Info.:
Target
Name:
Mu-type opioid receptor
Synonyms:
M-OR-1 | MOP | MOR-1 | MOR1 | MUOR1 | Mu Opioid Receptor | Mu opiate receptor | OPIATE Mu | OPRM1 | OPRM_HUMAN | hMOP | mu-type opioid receptor isoform MOR-1
Type:
G Protein-Coupled Receptor (GPCR)
Mol. Mass.:
44789.51
Organism:
Homo sapiens (Human)
Description:
P35372
Residue:
400
Sequence:
MDSSAAPTNASNCTDALAYSSCSPAPSPGSWVNLSHLDGNLSDPCGPNRTDLGGRDSLCPPTGSPSMITAITIMALYSIVCVVGLFGNFLVMYVIVRYTKMKTATNIYIFNLALADALATSTLPFQSVNYLMGTWPFGTILCKIVISIDYYNMFTSIFTLCTMSVDRYIAVCHPVKALDFRTPRNAKIINVCNWILSSAIGLPVMFMATTKYRQGSIDCTLTFSHPTWYWENLLKICVFIFAFIMPVLIITVCYGLMILRLKSVRMLSGSKEKDRNLRRITRMVLVVVAVFIVCWTPIHIYVIIKALVTIPETTFQTVSWHFCIALGYTNSCLNPVLYAFLDENFKRCFREFCIPTSSNIEQQNSTRIRQNTRDHPSTANTVDRTNHQLENLEAETAPLP
Inhibitor
Name:
BDBM50135220
Synonyms:
CHEMBL3746274
Type:
Small organic molecule
Emp. Form.:
C33H43N3O7
Mol. Mass.:
593.7104
SMILES:
[H][C@@]12Oc3c4c(C[C@@]5([H])N(C)CC[C@@]14[C@@]51C=C[C@@]2(OC)[C@@]2([H])C(=O)N(CCCCCCNC(=O)OC(C)(C)C)C(=O)[C@@]12[H])ccc3O |r,wU:20.24,41.47,13.12,1.0,wD:17.21,7.7,14.17,c:18,THB:10:9:14:4.5.6,(2.86,1.66,;2.59,.65,;4.54,.65,;5.3,-.89,;3.92,-1.67,;3.92,-3.21,;2.59,-3.95,;1.25,-3.19,;2.15,-2.66,;,-3.95,;-1.24,-4.15,;1.37,-4.28,;3.06,-2.3,;2.59,-.86,;1.25,-1.67,;1.65,-.29,;.65,.23,;1.25,1.43,;.1,2.51,;.41,3.73,;,.68,;-.12,1.72,;-1.56,1.16,;-1.95,2.35,;-2.41,,;-3.86,.62,;-4.04,2.17,;-5.49,2.79,;-5.13,4.32,;-6.27,5.39,;-5.92,6.92,;-7.06,7.99,;-6.71,9.52,;-5.5,9.89,;-7.85,10.59,;-7.49,12.12,;-8.41,12.98,;-7.21,13.34,;-6.29,12.49,;-1.56,-1.33,;-1.99,-2.51,;,-.86,;-.84,-.23,;5.3,-3.99,;6.65,-3.19,;6.65,-1.69,;7.74,-1.07,)|
Structure:
