Reaction Details 
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Adenosine receptor A2b
Ligand
BDBM50232059
Substrate
n/a
Meas. Tech.
ChEMBL_1646018 (CHEMBL3995074)
Ki
4.5±n/a nM
Citation
Basu, S; Barawkar, DA; Ramdas, V; Waman, Y; Patel, M; Panmand, A; Kumar, S; Thorat, S; Bonagiri, R; Jadhav, D; Mukhopadhyay, P; Prasad, V; Reddy, BS; Goswami, A; Chaturvedi, S; Menon, S; Quraishi, A; Ghosh, I; Dusange, S; Paliwal, S; Kulkarni, A; Karande, V; Thakre, R; Bedse, G; Rouduri, S; Gundu, J; Palle, VP; Chugh, A; Mookhtiar, KA A Eur J Med Chem 127:986-996 (2017) [PubMed] ArticleMore Info.:
Target
Name:
Adenosine receptor A2b
Synonyms:
AA2BR_HUMAN | ADENOSINE A2B | ADORA2B | Adenosine receptor A2B (A2B) | Adenosine receptors A2b | Adenosine receptors; A2a & A2b
Type:
G Protein-Coupled Receptor (GPCR)
Mol. Mass.:
36341.22
Organism:
Homo sapiens (Human)
Description:
n/a
Residue:
332
Sequence:
MLLETQDALYVALELVIAALSVAGNVLVCAAVGTANTLQTPTNYFLVSLAAADVAVGLFAIPFAITISLGFCTDFYGCLFLACFVLVLTQSSIFSLLAVAVDRYLAICVPLRYKSLVTGTRARGVIAVLWVLAFGIGLTPFLGWNSKDSATNNCTEPWDGTTNESCCLVKCLFENVVPMSYMVYFNFFGCVLPPLLIMLVIYIKIFLVACRQLQRTELMDHSRTTLQREIHAAKSLAMIVGIFALCWLPVHAVNCVTLFQPAQGKNKPKWAMNMAILLSHANSVVNPIVYAYRNRDFRYTFHKIISRYLLCQADVKSGNGQAGVQPALGVGL
Inhibitor
Name:
BDBM50232059
Synonyms:
CHEMBL4094755
Type:
Small organic molecule
Emp. Form.:
C25H26F3N7O3
Mol. Mass.:
529.5142
SMILES:
CCCn1c(=O)n(CC)c2nc([nH]c2c1=O)-c1cnn(CC2CN(C(=O)C2)c2cccc(c2)C(F)(F)F)c1
Structure:
