Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | PPOX | P50336 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | TDP2 | O95551 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.38 |
| ▸ | PRKD3 | O94806 | 3/20 | 0.38 |
| ▸ | EGFR | P00533 | 3/20 | 0.38 |
| ▸ | PRKCG | P05129 | 3/20 | 0.38 |
| ▸ | PRKCB | P05771 | 3/20 | 0.38 |
| ▸ | SRC | P12931 | 3/20 | 0.38 |
| ▸ | PRKCA | P17252 | 3/20 | 0.38 |
| ▸ | PRKCH | P24723 | 3/20 | 0.38 |
| ▸ | PRKCI | P41743 | 3/20 | 0.38 |
| ▸ | PRKCE | Q02156 | 3/20 | 0.38 |
| ▸ | PRKCQ | Q04759 | 3/20 | 0.38 |
| ▸ | PRKCZ | Q05513 | 3/20 | 0.38 |
| ▸ | PRKCD | Q05655 | 3/20 | 0.38 |
| ▸ | PRKD1 | Q15139 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3884186 | 0.85 | CES1 (0.37) | CES1PPOXGSK3BTDP2TDP1 | |
| SCHEMBL3871129 | 0.85 | CES1 (0.37) | CES1PPOXGSK3BTDP2TDP1 | |
| SCHEMBL10836481 | 0.79 | CA2 (0.54) | CES1PPOXGSK3BMEN1KMT2A | |
| SCHEMBL22070109 | 0.75 | ALOX15 (0.42) | CES1TDP1CYP3A4POLBALDH1A1 | |
| SCHEMBL2733540 | 0.75 | STK10 (0.35) | CES1PPOXGSK3BTDP2TDP1 | |
| SCHEMBL31586640 | 0.73 | TDP2 (0.59) | PPOXGSK3BTDP2TDP1MEN1 | |
| SCHEMBL5194204 | 0.73 | TDP2 (0.59) | PPOXGSK3BTDP2TDP1MEN1 | |
| SCHEMBL1081926 | 0.73 | GRM5 (0.55) | PPOXGSK3BTDP1PRKD3EGFR | |
| SCHEMBL8834408 | 0.72 | EGFR (0.56) | CES1TDP1PRKD3EGFRPRKCG | |
| SCHEMBL9839461 | 0.72 | CDC25B (0.41) | CES1POLBGLAMAOAMAOB |
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-6191307-B1 | Process for making benzoic acids | ALBEMARLE CORPORATION | 2001-02-20 | — | — | US | disclosed |