Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 5/20 | 0.47 |
| ▸ | SRC | P12931 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | CES2 | O00748 | 3/20 | 0.39 |
| ▸ | DAO | P14920 | 1/20 | 0.39 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2255352 | 0.83 | CES1 (0.54) | CES1SRCTSHRALDH1A1HSD17B10 | |
| SCHEMBL11856356 | 0.79 | CES1 (0.50) | CES1SRCTSHRALDH1A1HSD17B10 | |
| SCHEMBL1445897 | 0.79 | CES1 (0.54) | CES1SRCTSHRALDH1A1HSD17B10 | |
| SCHEMBL11308508 | 0.77 | CES1 (0.52) | CES1SRCTSHRALDH1A1HSD17B10 | |
| SCHEMBL11864550 | 0.77 | CES1 (0.52) | CES1SRCTSHRALDH1A1HSD17B10 | |
| SCHEMBL6050014 | 0.77 | CES1 (0.52) | CES1SRCTSHRALDH1A1HSD17B10 | |
| SCHEMBL5158726 | 0.75 | CES1 (0.61) | CES1SRCTSHRALDH1A1HSD17B10 | |
| SCHEMBL27638715 | 0.75 | CES1 (0.50) | CES1SRCTSHRALDH1A1HSD17B10 | |
| SCHEMBL5182474 | 0.75 | CES1 (0.50) | CES1SRCTSHRALDH1A1HSD17B10 | |
| SCHEMBL226691 | 0.73 | CES1 (0.58) | CES1SRCTSHRALDH1A1HSD17B10 |
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-3946071-A | HERBICIDES | MONSANTO COMPANY (US) | 1976-03-23 | — | — | US | disclosed |