Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.55 |
| ▸ | NPC1 | O15118 | 4/20 | 0.55 |
| ▸ | RAB9A | P51151 | 4/20 | 0.55 |
| ▸ | HPGD | P15428 | 3/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | F2 | P00734 | 1/20 | 0.46 |
| ▸ | IKBKB | O14920 | 1/20 | 0.45 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.43 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.43 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.42 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.42 |
| ▸ | KMO | O15229 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL16246615 | 0.86 | ALOX15 (0.49) | ALDH1A1KDM4ENPC1RAB9AHPGD | |
| SCHEMBL8405503 | 0.78 | ALDH1A1 (0.62) | ALDH1A1KDM4ENPC1RAB9AHPGD | |
| SCHEMBL364613 | 0.78 | CYP2A6 (0.51) | ALDH1A1KDM4ENPC1RAB9AHPGD | |
| SCHEMBL370029 | 0.77 | ALDH1A1 (0.59) | ALDH1A1KDM4ENPC1RAB9AHPGD | |
| SCHEMBL3789884 | 0.76 | KDM4E (0.59) | ALDH1A1KDM4ENPC1RAB9AHPGD | |
| SCHEMBL27790042 | 0.75 | ALDH1A1 (0.57) | ALDH1A1KDM4ENPC1RAB9AHPGD | |
| SCHEMBL370075 | 0.73 | CYP2A6 (0.51) | ALDH1A1KDM4ENPC1RAB9AHPGD | |
| SCHEMBL2724814 | 0.73 | ALDH1A1 (0.51) | ALDH1A1KDM4ENPC1RAB9AHPGD | |
| SCHEMBL13188470 | 0.73 | ALDH1A1 (0.62) | ALDH1A1KDM4ENPC1RAB9AHPGD | |
| SCHEMBL4881571 | 0.71 | RAB9A (1.00) | ALDH1A1KDM4ENPC1RAB9AHPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-2593447-A2 | NEW HETEROCYCLIC COMPOUNDS AS PESTICIDES | Bayer Intellectual Property GmbH (DE) | 2013-05-22 | — | — | EP | disclosed |
| WO-2012007500-A2 | NEW HETEROCYCLIC COMPOUNDS AS PESTICIDES | BAYER CROPSCIENCE AG (DE) | 2012-01-19 | — | — | WO | disclosed |