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Name | Adenosine receptor A1 |
---|---|
Species | Homo sapiens (Human) |
Gene | ADORA1 |
Synonym | RDC7 A1 receptor A1-AR A1R adenosine receptor A1 |
Disease | Cardiac arrhythmias Hypertension Cardiac disease Cognitive disorders Diabetes [ Show all ] |
Length | 326 |
Amino acid sequence | MPPSISAFQAAYIGIEVLIALVSVPGNVLVIWAVKVNQALRDATFCFIVSLAVADVAVGALVIPLAILINIGPQTYFHTCLMVACPVLILTQSSILALLAIAVDRYLRVKIPLRYKMVVTPRRAAVAIAGCWILSFVVGLTPMFGWNNLSAVERAWAANGSMGEPVIKCEFEKVISMEYMVYFNFFVWVLPPLLLMVLIYLEVFYLIRKQLNKKVSASSGDPQKYYGKELKIAKSLALILFLFALSWLPLHILNCITLFCPSCHKPSILTYIAIFLTHGNSAMNPIVYAFRIQKFRVTFLKIWNDHFRCQPAPPIDEDLPEERPDD |
UniProt | P30542 |
Protein Data Bank | 6d9h, 5n2s |
GPCR-HGmod model | P30542 |
3D structure model | This structure is from PDB ID 6d9h. |
BioLiP | BL0385576, BL0417675 |
Therapeutic Target Database | T88714, T92072 |
ChEMBL | CHEMBL226 |
IUPHAR | 18 |
DrugBank | BE0000013 |
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GLASS ID | Molecule | Formula | Molecular weight | H-bond acceptor / donor | XlogP | Lipinski's druglikeness |
---|---|---|---|---|---|---|
45 | CHEMBL574416 | C17H12N4O | 288.31 | 3 / 1 | 2.7 | Yes |
69 | Pyrimidin-4-ylacetamide, 26 | C19H24N6O2 | 368.441 | 6 / 1 | 2.0 | Yes |
187 | CHEMBL473650 | C21H14N6O2 | 382.383 | 5 / 1 | 2.8 | Yes |
238 | CHEMBL437168 | C26H26ClN7O6 | 567.987 | 10 / 5 | 2.2 | No |
365 | CHEMBL573125 | C28H31ClN6O5 | 567.043 | 9 / 4 | 2.5 | No |
547903 | CHEMBL3938269 | C19H14ClN3 | 319.792 | 3 / 1 | 4.6 | Yes |
476 | CHEMBL38304 | C28H32N6O4 | 516.602 | 6 / 2 | 3.2 | No |
690 | CHEMBL196259 | C16H16N8 | 320.36 | 6 / 1 | 2.3 | Yes |
521465 | CHEMBL3827623 | C26H36N6O3 | 480.613 | 6 / 0 | 3.9 | Yes |
799 | CHEMBL2170801 | C22H30ClN5O2 | 431.965 | 6 / 3 | 4.2 | Yes |
800 | CHEMBL468370 | C16H11N3O | 261.284 | 4 / 1 | 3.2 | Yes |
808 | CHEMBL2089347 | C27H24ClN5O2 | 485.972 | 6 / 3 | 4.2 | Yes |
829 | CHEMBL382194 | C18H20IN7O4 | 525.307 | 8 / 5 | 0.4 | No |
871 | CHEMBL481383 | C20H23N5O2 | 365.437 | 3 / 0 | 3.6 | Yes |
936 | 2-amino-4-(1,3-benzodioxol-5-yl)-6-methoxypyridine-3,5-dicarbonitrile | C15H10N4O3 | 294.27 | 7 / 1 | 2.2 | Yes |
991 | CHEMBL1927632 | C8H7N7O | 217.192 | 7 / 2 | -0.1 | Yes |
997 | CHEMBL208311 | C25H30N6O4 | 478.553 | 8 / 4 | 2.7 | Yes |
1044 | Pyrimidin-4-ylacetamide, 9 | C20H24N6O3 | 396.451 | 7 / 1 | 1.7 | Yes |
1091 | CHEMBL609297 | C15H19ClN4OS | 338.854 | 5 / 4 | N/A | N/A |
1202 | CHEMBL178846 | C22H25ClN6O5 | 488.929 | 9 / 4 | 1.3 | Yes |
463133 | CHEMBL3613140 | C24H16ClN5O2S | 473.935 | 8 / 1 | 5.2 | No |
1448 | CHEMBL3121728 | C27H31ClN6O3 | 523.034 | 6 / 1 | 3.6 | No |
1478 | CHEMBL1650163 | C18H13F2N3O | 325.319 | 5 / 1 | 3.2 | Yes |
1546 | SCHEMBL1497826 | C22H20Cl3N3OS | 480.832 | 5 / 1 | 6.5 | No |
441733 | CID 118733042 | C10H8N4OS | 232.261 | 4 / 1 | 1.1 | Yes |
1715 | CHEMBL1094143 | C25H19N5O | 405.461 | 4 / 1 | 4.6 | Yes |
1990 | CHEMBL515442 | C19H20ClIN6O5 | 574.76 | 9 / 4 | 1.7 | No |
2123 | CHEMBL2112158 | C21H23ClN6O3 | 442.904 | 7 / 4 | 1.7 | Yes |
2147 | CHEMBL434692 | C18H14BrNOS | 372.28 | 3 / 1 | 5.8 | No |
2241 | CHEMBL259178 | C16H15N5O2 | 309.329 | 6 / 2 | 1.9 | Yes |
557362 | CHEMBL2312720 | C18H13N3O3 | 319.32 | 4 / 1 | 2.9 | Yes |
441765 | CHEMBL3410319 | C23H15F4N5O4 | 501.398 | 11 / 0 | 3.9 | No |
2309 | CHEMBL218837 | C19H20ClN7O5 | 461.863 | 9 / 5 | 0.9 | Yes |
2318 | CHEMBL366216 | C19H25N7 | 351.458 | 6 / 3 | 4.2 | Yes |
521525 | CHEMBL3785142 | C14H17NO3S | 279.354 | 4 / 1 | 1.8 | Yes |
463233 | CHEMBL3613138 | C18H13N5O2S | 363.395 | 7 / 1 | 4.0 | Yes |
2994 | RWJ-68354 | C19H15FN4O | 334.354 | 5 / 2 | 3.3 | Yes |
3060 | CHEMBL376920 | C19H15N3 | 285.35 | 3 / 1 | 4.4 | Yes |
3106 | Pyrimidin-4-ylacetamide, 6 | C22H29N7O2 | 423.521 | 7 / 1 | 2.2 | Yes |
3208 | SCHEMBL4154525 | C17H16F3NOS | 339.376 | 6 / 1 | 5.8 | No |
3483 | CHEMBL56534 | C17H11BrN2O3S | 403.25 | 5 / 1 | 5.6 | No |
3620 | CHEMBL1927430 | C19H28N8O5 | 448.484 | 11 / 3 | 1.0 | No |
3674 | CHEMBL490250 | C17H22ClN5O4 | 395.844 | 8 / 4 | 2.3 | Yes |
3790 | CHEMBL186443 | C19H20N8O4 | 424.421 | 10 / 4 | -0.4 | Yes |
3815 | CHEMBL257256 | C16H18ClN3O2S | 351.849 | 5 / 1 | 3.9 | Yes |
3855 | 316173-57-6 | C20H19N7O2 | 389.419 | 7 / 1 | 2.7 | Yes |
3959 | CHEMBL2391832 | C20H13N3O3S | 375.402 | 6 / 1 | 3.8 | Yes |
4042 | CHEMBL428716 | C22H29N7O6 | 487.517 | 11 / 4 | 1.1 | No |
517337 | SCHEMBL246621 | C29H29N5O3S | 527.643 | 8 / 2 | 4.1 | No |
4087 | CHEMBL235717 | C24H18ClN5O3 | 459.89 | 5 / 1 | 5.7 | No |
557400 | CHEMBL3800558 | C37H41N5O4 | 619.766 | 7 / 4 | 5.7 | No |
4118 | CHEMBL465640 | C17H11F3N4 | 328.298 | 6 / 1 | 4.0 | Yes |
4209 | CHEMBL278805 | C22H22Cl2N8O3S | 549.431 | 9 / 1 | 2.7 | No |
4239 | CHEMBL446264 | C8H10BrN5 | 256.107 | 4 / 1 | 1.4 | Yes |
4354 | CHEMBL22355 | C21H17N7O5 | 447.411 | 10 / 2 | 2.2 | Yes |
4373 | CHEMBL56115 | C24H19NOS | 369.482 | 3 / 1 | 6.8 | No |
4383 | CHEMBL3087709 | C23H17N5O2 | 395.422 | 5 / 1 | 3.6 | Yes |
4437 | CHEMBL574490 | C19H13Cl2N7O2 | 442.26 | 6 / 1 | 3.2 | Yes |
4514 | CHEMBL575605 | C31H25N7O2 | 527.588 | 6 / 1 | 5.4 | No |
4604 | CHEMBL3125715 | C22H29N5O2 | 395.507 | 6 / 3 | 3.1 | Yes |
4653 | ethyl 2-amino-4-(3-(trifluoromethyl)phenyl)thiophene-3-carboxylate | C14H12F3NO2S | 315.31 | 7 / 1 | 4.5 | Yes |
4684 | 3-(4-bromobenzoyl)-4H,5H,6H-cyclopenta[b]thiophen-2-amine | C14H12BrNOS | 322.22 | 3 / 1 | 4.5 | Yes |
521590 | 871266-83-0 | C11H6ClN5O2S | 307.712 | 7 / 1 | 3.7 | Yes |
4750 | CHEMBL27376 | C20H20ClIN6O3 | 554.773 | 7 / 4 | 2.0 | No |
4759 | CHEMBL376778 | C20H19N3O | 317.392 | 3 / 1 | 4.1 | Yes |
4816 | CHEMBL1171381 | C31H37N5O4 | 543.668 | 5 / 0 | 4.4 | No |
4836 | CID 44327951 | C15H18ClN5O3 | 351.791 | 5 / 1 | 1.0 | Yes |
4866 | CHEMBL611552 | C20H22N10O7 | 514.459 | 14 / 5 | -0.1 | No |
4869 | CHEMBL2413111 | C20H22N10O7 | 514.459 | 14 / 5 | -0.1 | No |
4871 | CHEMBL611552 | C20H22N10O7 | 514.459 | 14 / 5 | -0.1 | No |
4877 | CHEMBL1258192 | C22H23N7O2 | 417.473 | 7 / 1 | 3.5 | Yes |
4933 | CHEMBL255861 | C20H15ClN4O3S | 426.875 | 7 / 1 | 3.9 | Yes |
4994 | CHEMBL2042308 | C49H58N8O5 | 839.054 | 10 / 6 | 9.0 | No |
441903 | CHEMBL1766351 | C21H15ClN4O2 | 390.827 | 3 / 2 | 4.1 | Yes |
5153 | CHEMBL1088665 | C23H24N6O | 400.486 | 7 / 2 | 2.1 | Yes |
5183 | CHEMBL565074 | C17H12INOS | 405.253 | 3 / 1 | 5.4 | No |
5193 | triazine-4-carboxamide, 6 | C15H12ClN5O2 | 329.744 | 6 / 2 | 2.1 | Yes |
441908 | CHEMBL3415043 | C13H12N4O2S | 288.325 | 6 / 2 | 2.2 | Yes |
463517 | CHEMBL3612943 | C20H20ClN9O3S | 501.95 | 10 / 4 | 1.0 | No |
5374 | CHEMBL3093315 | C17H17N5O2S | 355.416 | 5 / 0 | 1.4 | Yes |
5610 | UNII-29S2U9DRGS | C27H28N6O5 | 516.558 | 8 / 1 | 5.7 | No |
5625 | CHEMBL589513 | C43H56ClN11O7S | 906.501 | 12 / 9 | 1.2 | No |
5627 | CHEMBL583748 | C43H56ClN11O7S | 906.501 | 12 / 9 | 1.2 | No |
5633 | 2-(1-hexynyl)adenosine | C16H21N5O4 | 347.375 | 8 / 4 | 1.3 | Yes |
5788 | CHEMBL108552 | C25H31FN4O5S | 518.604 | 7 / 1 | 5.8 | No |
521628 | CHEMBL3799847 | C20H18ClN5O4S | 459.905 | 8 / 3 | 1.6 | Yes |
5906 | CHEMBL574352 | C13H12N4O | 240.266 | 3 / 1 | 1.4 | Yes |
5958 | CHEMBL220386 | C21H21FN6O5 | 456.434 | 10 / 4 | 1.3 | Yes |
5989 | CHEMBL595981 | C25H32ClN3O5S | 522.057 | 7 / 1 | 4.9 | No |
6068 | CHEMBL255649 | C20H16N4O3S | 392.433 | 7 / 1 | 3.3 | Yes |
463628 | CHEMBL3613133 | C25H19N5O2S2 | 485.58 | 9 / 1 | 5.1 | No |
6392 | triazine-4-carboxamide, 13 | C15H14N6O2 | 310.317 | 7 / 2 | 0.8 | Yes |
6462 | CHEMBL208530 | C12H17N7O4 | 323.313 | 8 / 5 | -1.0 | Yes |
441942 | CHEMBL3314874 | C27H26N6O4 | 498.543 | 8 / 2 | 3.8 | Yes |
441945 | CHEMBL3410309 | C19H21N5O3 | 367.409 | 6 / 1 | 3.0 | Yes |
6504 | CHEMBL142926 | C23H22N8O3 | 458.482 | 7 / 2 | 3.3 | Yes |
463670 | CHEMBL3581311 | C19H26N10O | 410.486 | 7 / 2 | 1.1 | Yes |
6699 | CHEMBL210642 | C18H16N6O3 | 364.365 | 6 / 2 | 1.2 | Yes |
6734 | MRS 1754 | C26H26N6O4 | 486.532 | 6 / 2 | 4.9 | Yes |
6821 | CHEMBL90298 | C19H23N5O3 | 369.425 | 4 / 2 | 3.4 | Yes |
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