Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 10/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.55 |
| ▸ | TPSAB1 | Q15661 | 3/20 | 0.53 |
| ▸ | TPSD1 | Q9BZJ3 | 3/20 | 0.53 |
| ▸ | TPSG1 | Q9NRR2 | 3/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | NPC1 | O15118 | 2/20 | 0.52 |
| ▸ | RAB9A | P51151 | 2/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | F2 | P00734 | 2/20 | 0.49 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.49 |
| ▸ | F13A1 | P00488 | 1/20 | 0.49 |
| ▸ | TGM2 | P21980 | 1/20 | 0.49 |
| ▸ | TGM1 | P22735 | 1/20 | 0.49 |
| ▸ | PLG | P00747 | 1/20 | 0.49 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.49 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL29532829 | 0.90 | GRIN2B (0.67) | GRIN2BCYP2D6CYP2C9TPSAB1TPSD1 | |
| SCHEMBL5566410 | 0.89 | CTSK (0.46) | GRIN2BCYP2D6CYP2C9CYP3A4SMN1; SMN2 | |
| SCHEMBL1240612 | 0.84 | TPSAB1 (0.58) | GRIN2BCYP2D6CYP2C9TPSAB1TPSD1 | |
| SCHEMBL1241067 | 0.83 | KDM4E (0.69) | GRIN2BCYP2D6CYP2C9TPSAB1TPSD1 | |
| SCHEMBL3824687 | 0.83 | CTSK (0.51) | SMN1; SMN2NPC1RAB9AHTT | |
| SCHEMBL25248629 | 0.82 | GRIN2B (0.64) | GRIN2BCYP2D6CYP2C9TPSAB1TPSD1 | |
| SCHEMBL5351275 | 0.81 | KDM4E (0.62) | GRIN2BCYP2D6CYP2C9TPSAB1TPSD1 | |
| SCHEMBL20135734 | 0.81 | MEN1 (0.61) | GRIN2BCYP2C9SMN1; SMN2NPC1RAB9A | |
| SCHEMBL4076025 | 0.81 | DPP4 (0.59) | SMN1; SMN2NPC1RAB9A | |
| SCHEMBL20660273 | 0.80 | KDM4E (0.64) | GRIN2BCYP2D6CYP2C9SMN1; SMN2NPC1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2007068739-A1 | 4-AMINO-BENZAMIDE DERIVATIVES AS 5-HT4 RECEPTOR AGONISTS FOR THE TREATMENT OF GASTROINTESTINAL, NEUROLOGICAL AND CARDIOVASCULAR DISORDERS | GLAXO GROUP LIMITED (GB) | 2007-06-21 | — | — | WO | disclosed |