Reaction Details Report a problem with these data
Target
Glutamate receptor ionotropic, NMDA 2A
Ligand
BDBM521614
Substrate
n/a
Meas. Tech.
Whole-Cell Patch Clamp of Mammalian Cells (Ionworks Barracuda (IWB))
EC50
33.6±n/a nM
Citation
 Salituro, FG; Robichaud, AJ; Martinez Botella, G; Harrison, BL; Griffin, A Oxysterols and methods of use thereof US Patent  US11149054 Publication Date 10/19/2021 
Target
Name:
Glutamate receptor ionotropic, NMDA 2A
Synonyms:
GRIN2A | GluN2A | Glutamate [NMDA] receptor | Glutamate [NMDA] receptor subunit epsilon 1 | Glutamate [NMDA] receptor subunit epsilon-1 | N-methyl D-aspartate receptor subtype 2A | NMDA receptor subtype 2A protein (NR2A) | NMDAR2A | NMDE1_HUMAN | NR2A | hNR2A
Type:
n/a
Mol. Mass.:
165293.76
Organism:
Homo sapiens (Human)
Description:
n/a
Residue:
1464
Sequence:
MGRVGYWTLLVLPALLVWRGPAPSAAAEKGPPALNIAVMLGHSHDVTERELRTLWGPEQAAGLPLDVNVVALLMNRTDPKSLITHVCDLMSGARIHGLVFGDDTDQEAVAQMLDFISSHTFVPILGIHGGASMIMADKDPTSTFFQFGASIQQQATVMLKIMQDYDWHVFSLVTTIFPGYREFISFVKTTVDNSFVGWDMQNVITLDTSFEDAKTQVQLKKIHSSVILLYCSKDEAVLILSEARSLGLTGYDFFWIVPSLVSGNTELIPKEFPSGLISVSYDDWDYSLEARVRDGIGILTTAASSMLEKFSYIPEAKASCYGQMERPEVPMHTLHPFMVNVTWDGKDLSFTEEGYQVHPRLVVIVLNKDREWEKVGKWENHTLSLRHAVWPRYKSFSDCEPDDNHLSIVTLEEAPFVIVEDIDPLTETCVRNTVPCRKFVKINNSTNEGMNVKKCCKGFCIDILKKLSRTVKFTYDLYLVTNGKHGKKVNNVWNGMIGEVVYQRAVMAVGSLTINEERSEVVDFSVPFVETGISVMVSRSNGTVSPSAFLEPFSASVWVMMFVMLLIVSAIAVFVFEYFSPVGYNRNLAKGKAPHGPSFTIGKAIWLLWGLVFNNSVPVQNPKGTTSKIMVSVWAFFAVIFLASYTANLAAFMIQEEFVDQVTGLSDKKFQRPHDYSPPFRFGTVPNGSTERNIRNNYPYMHQYMTKFNQKGVEDALVSLKTGKLDAFIYDAAVLNYKAGRDEGCKLVTIGSGYIFATTGYGIALQKGSPWKRQIDLALLQFVGDGEMEELETLWLTGICHNEKNEVMSSQLDIDNMAGVFYMLAAAMALSLITFIWEHLFYWKLRFCFTGVCSDRPGLLFSISRGIYSCIHGVHIEEKKKSPDFNLTGSQSNMLKLLRSAKNISSMSNMNSSRMDSPKRAADFIQRGSLIMDMVSDKGNLMYSDNRSFQGKESIFGDNMNELQTFVANRQKDNLNNYVFQGQHPLTLNESNPNTVEVAVSTESKANSRPRQLWKKSVDSIRQDSLSQNPVSQRDEATAENRTHSLKSPRYLPEEMAHSDISETSNRATCHREPDNSKNHKTKDNFKRSVASKYPKDCSEVERTYLKTKSSSPRDKIYTIDGEKEPGFHLDPPQFVENVTLPENVDFPDPYQDPSENFRKGDSTLPMNRNPLHNEEGLSNNDQYKLYSKHFTLKDKGSPHSETSERYRQNSTHCRSCLSNMPTYSGHFTMRSPFKCDACLRMGNLYDIDEDQMLQETGNPATGEQVYQQDWAQNNALQLQKNKLRISRQHSYDNIVDKPRELDLSRPSRSISLKDRERLLEGNFYGSLFSVPSSKLSGKKSSLFPQGLEDSKRSKSLLPDHTSDNPFLHSHRDDQRLVIGRCPSDPYKHSLPSQAVNDSYLRSSLRSTASYCSRDSRGHNDVYISEHVMPYAANKNNMYSTPRVLNSCSNRRVYKKMPSIESDV
  
Inhibitor
Name:
BDBM521614
Synonyms:
US11149054, Compound 5131
Type:
Small organic molecule
Emp. Form.:
C31H49F5O3
Mol. Mass.:
564.711
SMILES:
C[C@H](CCC1(O)CCC(CC1)OC(F)F)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@](O)(CC[C@]4(C)[C@H]3CC[C@]12C)C(F)(F)F |r,wU:22.23,30.33,18.18,24.25,28.30,15.15,33.38,wD:19.20,24.39,1.0,(-.9,4.24,;.13,3.09,;1.64,3.41,;2.67,2.27,;4.17,2.59,;4.17,4.13,;3.78,1.1,;4.86,.01,;6.35,.41,;6.75,1.9,;5.66,2.99,;7.44,-.68,;8.93,-.28,;10.02,-1.37,;9.33,1.21,;-.34,1.63,;.56,.38,;-.34,-.86,;-1.81,-.39,;-3.14,-1.16,;-3.14,-2.7,;-4.48,-3.47,;-5.81,-2.7,;-7.14,-3.47,;-8.48,-2.7,;-9.57,-3.79,;-8.48,-1.16,;-7.14,-.39,;-5.81,-1.16,;-5.81,.38,;-4.48,-.39,;-4.48,1.15,;-3.14,1.92,;-1.81,1.15,;-1.65,2.68,;-10.02,-2.7,;-10.79,-1.36,;-10.79,-4.03,;-11.56,-2.7,)|
Structure:
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