Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.41 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | PDE4A | P27815 | 2/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.35 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | GCK | P35557 | 1/20 | 0.34 |
| ▸ | EGFR | P00533 | 2/20 | 0.33 |
| ▸ | KDR | P35968 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL571781 | 0.79 | KDM4E (0.53) | KDM4EALDH1A1MAPK1PDE4APDE4B | |
| SCHEMBL14969486 | 0.79 | KDM4E (0.53) | KDM4EALDH1A1MAPK1PDE4APDE4B | |
| Water SCHEMBL6469704 | 0.78 | KDM4E (0.52) | KDM4EALDH1A1MAPK1PDE4APDE4B | |
| SCHEMBL16394167 | 0.76 | TAS1R3 (0.39) | TAS1R3TAS1R1KDM4EALDH1A1MAPK1 | |
| SCHEMBL23605890 | 0.71 | TAS1R3 (0.44) | TAS1R3TAS1R1TDP1GAACYP1A2 | |
| SCHEMBL22349265 | 0.71 | TAS1R3 (0.45) | TAS1R3TAS1R1KDM4EALDH1A1MAPK1 | |
| SCHEMBL24715864 | 0.71 | MAPT (0.44) | KDM4EALDH1A1MAPK1PDE4APDE4B | |
| SCHEMBL10920918 | 0.71 | KDM4E (0.48) | KDM4EALDH1A1PKMTP53KMT2A | |
| SCHEMBL2329831 | 0.69 | ALDH1A1 (0.44) | TAS1R3TAS1R1KDM4EALDH1A1MAPK1 | |
| SCHEMBL22542389 | 0.69 | SMN1; SMN2 (0.43) | TAS1R3TAS1R1KDM4EALDH1A1MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8153788-B2 | Substituted 2,4-diamino-1,3,5-triazines, processes for their use as herbicides and crop growth regulators | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2012-04-10 | — | — | US | disclosed |