Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B10 | O60218 | 7/20 | 0.59 |
| ▸ | AKR1B1 | P15121 | 7/20 | 0.59 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.59 |
| ▸ | LMNA | P02545 | 2/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | RECQL | P46063 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.52 |
| ▸ | MAOB | P27338 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.45 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | GMNN | O75496 | 1/20 | 0.45 |
| ▸ | EGFR | P00533 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL355843 | 0.89 | HCAR2 (0.72) | AKR1B10AKR1B1HCAR2LMNASMN1; SMN2 | |
| SCHEMBL8708780 | 0.89 | HCAR2 (0.72) | AKR1B10AKR1B1HCAR2LMNASMN1; SMN2 | |
| SCHEMBL355844 | 0.89 | HCAR2 (0.72) | AKR1B10AKR1B1HCAR2LMNASMN1; SMN2 | |
| Phenylpropyl Fumarate SCHEMBL3482832 | 0.84 | HCAR2 (0.81) | AKR1B10AKR1B1HCAR2LMNASMN1; SMN2 | |
| Phenylpropyl Fumarate SCHEMBL3482828 | 0.84 | HCAR2 (0.81) | AKR1B10AKR1B1HCAR2LMNASMN1; SMN2 | |
| Phenylpropyl Fumarate SCHEMBL27216278 | 0.84 | HCAR2 (0.81) | AKR1B10AKR1B1HCAR2LMNASMN1; SMN2 | |
| SCHEMBL11039162 | 0.83 | HCAR2 (0.68) | AKR1B10AKR1B1HCAR2LMNASMN1; SMN2 | |
| SCHEMBL28500282 | 0.83 | HCAR2 (0.68) | AKR1B10AKR1B1HCAR2LMNASMN1; SMN2 | |
| SCHEMBL11039156 | 0.83 | HCAR2 (0.68) | AKR1B10AKR1B1HCAR2LMNASMN1; SMN2 | |
| SCHEMBL11039389 | 0.83 | HCAR2 (0.68) | AKR1B10AKR1B1HCAR2LMNASMN1; SMN2 |
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-5187165-A | Eseroline derivatives; cholinergic agents; antidepressants | HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) | 1993-02-16 | — | — | US | disclosed |