Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 2/20 | 0.59 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.59 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.59 |
| ▸ | AGTR1 | P30556 | 2/20 | 0.59 |
| ▸ | PTGIR | P43119 | 2/20 | 0.59 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.59 |
| ▸ | PTGDR | Q13258 | 2/20 | 0.59 |
| ▸ | DRD1 | P21728 | 1/20 | 0.59 |
| ▸ | CKS1B | P61024 | 10/20 | 0.53 |
| ▸ | SKP1 | P63208 | 10/20 | 0.53 |
| ▸ | SKP2 | Q13309 | 10/20 | 0.53 |
| ▸ | CNR1 | P21554 | 2/20 | 0.53 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.53 |
| ▸ | HTR1A | P08908 | 1/20 | 0.53 |
| ▸ | HTR2A | P28223 | 1/20 | 0.53 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.53 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.53 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.53 |
| ▸ | HTR2B | P41595 | 1/20 | 0.53 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.53 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL19823460 | 1.00 | NR1I2 (0.59) | NR1I2ADORA3TBXA2RAGTR1PTGIR | |
| SCHEMBL19823480 | 0.91 | NR1I2 (0.67) | NR1I2ADORA3TBXA2RAGTR1PTGIR | |
| SCHEMBL19823477 | 0.90 | NR1I2 (0.64) | NR1I2ADORA3TBXA2RAGTR1PTGIR | |
| SCHEMBL19823485 | 0.88 | NR1I2 (0.74) | NR1I2ADORA3TBXA2RAGTR1PTGIR | |
| SCHEMBL19823454 | 0.88 | NR1I2 (0.74) | NR1I2ADORA3TBXA2RAGTR1PTGIR | |
| SCHEMBL19823479 | 0.88 | NR1I2 (0.74) | NR1I2ADORA3TBXA2RAGTR1PTGIR | |
| SCHEMBL5218495 | 0.87 | NR1I2 (0.78) | NR1I2ADORA3TBXA2RAGTR1PTGIR | |
| SCHEMBL19820817 | 0.86 | NR1I2 (0.77) | NR1I2ADORA3TBXA2RAGTR1PTGIR | |
| Potassium Ion SCHEMBL28690605 | 0.86 | ADORA3 (0.62) | NR1I2ADORA3TBXA2RAGTR1PTGIR | |
| SCHEMBL19823459 | 0.84 | NR1I2 (0.58) | NR1I2ADORA3TBXA2RAGTR1PTGIR |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109563055-B | Aminopyrazine compound or salt, isomer, preparation method and application thereof | 成都苑东生物制药股份有限公司 | 2021-12-24 | — | — | CN | disclosed |
| WO-2018019296-A1 | AMINOPYRAZINE COMPOUND, SALT, OR ISOMER, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF | 成都苑东生物制药股份有限公司 | 2018-02-01 | — | — | WO | disclosed |