Reaction Details |
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Target | Adenosine receptor A2a/A2b |
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Ligand | BDBM50017980 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_30864 (CHEMBL646361) |
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Ki | 472±n/a nM |
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Citation | Jacobson, KA; Barone, S; Kammula, U; Stiles, GL Electrophilic derivatives of purines as irreversible inhibitors of A1 adenosine receptors. J Med Chem32:1043-51 (1989) [PubMed] |
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More Info.: | Get all data from this article, Assay Method |
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Adenosine receptor A2a/A2b |
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Name: | Adenosine receptor A2a/A2b |
Synonyms: | Adenosine A2 receptor |
Type: | n/a |
Mol. Mass.: | n/a |
Description: | ASSAY_ID of ChEMBL is 30560 |
Components: | This complex has 2 components. |
Component 1 |
Name: | Adenosine receptor A2b |
Synonyms: | AA2BR_RAT | Adenosine receptor | Adora2b |
Type: | PROTEIN |
Mol. Mass.: | 36378.84 |
Organism: | Rattus norvegicus |
Description: | ChEMBL_32934 |
Residue: | 332 |
Sequence: | MQLETQDALYVALELVIAALAVAGNVLVCAAVGASSALQTPTNYFLVSLATADVAVGLFA
IPFAITISLGFCTDFHSCLFLACFVLVLTQSSIFSLLAVAVDRYLAIRVPLRYKGLVTGT
RARGIIAVLWVLAFGIGLTPFLGWNSKDRATSNCTEPGDGITNKSCCPVKCLFENVVPMS
YMVYFNFFGCVLPPLLIMMVIYIKIFMVACKQLQHMELMEHSRTTLQREIHAAKSLAMIV
GIFALCWLPVHAINCITLFHPALAKDKPKWVMNVAILLSHANSVVNPIVYAYRNRDFRYS
FHRIISRYVLCQTDTKGGSGQAGGQSTFSLSL
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Component 2 |
Name: | Adenosine receptor A2a |
Synonyms: | AA2AR_RAT | ADENOSINE A2a | Adenosine A2 receptor | Adenosine A2a receptor (A2a) | Adenosine Receptors A2a (A2a) | Adenosine receptor A2a and A3 | Adenosine receptors A2a | Adora2a | Rat striatal adenosine A2a receptor |
Type: | G Protein-Coupled Receptor (GPCR) |
Mol. Mass.: | 45015.65 |
Organism: | Rattus norvegicus (rat) |
Description: | Rat A2A receptors expressed in CHO cells. |
Residue: | 410 |
Sequence: | MGSSVYITVELAIAVLAILGNVLVCWAVWINSNLQNVTNFFVVSLAAADIAVGVLAIPFA
ITISTGFCAACHGCLFFACFVLVLTQSSIFSLLAIAIDRYIAIRIPLRYNGLVTGVRAKG
IIAICWVLSFAIGLTPMLGWNNCSQKDGNSTKTCGEGRVTCLFEDVVPMNYMVYYNFFAF
VLLPLLLMLAIYLRIFLAARRQLKQMESQPLPGERTRSTLQKEVHAAKSLAIIVGLFALC
WLPLHIINCFTFFCSTCRHAPPWLMYLAIILSHSNSVVNPFIYAYRIREFRQTFRKIIRT
HVLRRQEPFQAGGSSAWALAAHSTEGEQVSLRLNGHPLGVWANGSATHSGRRPNGYTLGL
GGGGSAQGSPRDVELPTQERQEGQEHPGLRGHLVQARVGASSWSSEFAPS
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BDBM50017980 |
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n/a |
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Name | BDBM50017980 |
Synonyms: | CHEMBL275232 | N-(2-{2-[4-(2,6-Dioxo-1,3-dipropyl-2,3,6,7-tetrahydro-1H-purin-8-yl)-phenoxy]-acetylamino}-ethyl)-2-[3-(4-isothiocyanato-phenyl)-thioureido]-acetamide |
Type | Small organic molecule |
Emp. Form. | C31H35N9O5S2 |
Mol. Mass. | 677.797 |
SMILES | CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)-c1ccc(OCC(=O)NCCNC(=O)CNC(=S)Nc2ccc(cc2)N=C=S)cc1 |
Structure |
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