Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.49 |
| ▸ | TAS1R3 | Q7RTX0 | 6/20 | 0.48 |
| ▸ | TAS1R1 | Q7RTX1 | 6/20 | 0.48 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | DPP4 | P27487 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL27977033 | 0.85 | ABCG2 (0.50) | ABCG2TAS1R3TAS1R1NPC1RAB9A | |
| SCHEMBL30307376 | 0.84 | CYP1A2 (0.63) | ABCG2NPC1KMT2AMEN1ALDH1A1 | |
| SCHEMBL547153 | 0.84 | CYP1A2 (0.63) | ABCG2NPC1KMT2AMEN1ALDH1A1 | |
| SCHEMBL16959104 | 0.83 | SMN1; SMN2 (0.44) | TAS1R3TAS1R1NPC1RAB9AKMT2A | |
| SCHEMBL28643734 | 0.81 | TUBB1 (0.55) | ABCG2RAB9AKMT2AMEN1ALDH1A1 | |
| SCHEMBL2091206 | 0.81 | TAS1R3 (0.51) | TAS1R3TAS1R1NPC1RAB9AKMT2A | |
| SCHEMBL5585484 | 0.81 | ALDH1A1 (0.59) | ABCG2NPC1RAB9AKMT2AMEN1 | |
| SCHEMBL5585477 | 0.81 | ALDH1A1 (0.59) | ABCG2NPC1RAB9AKMT2AMEN1 | |
| SCHEMBL11575925 | 0.80 | CYP1A2 (0.68) | TAS1R3TAS1R1NPC1RAB9AKMT2A | |
| SCHEMBL11320111 | 0.80 | KMT2A (0.50) | TAS1R3TAS1R1NPC1RAB9AKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2942345-B1 | 3,4,5-TRIMETHOXYSTYRYLARYLAMINOPROPENONES FOR THE TREATMENT OF CANCER | COUNCIL SCIENT IND RES (IN) | 2018-03-28 | — | — | EP | disclosed |