Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC42 | P60953 | 3/20 | 0.41 |
| ▸ | RAC1 | P63000 | 3/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11197597 | 0.95 | CDC42 (0.40) | CDC42RAC1PTGS2PTGS1NPC1 | |
| SCHEMBL17361251 | 0.89 | CDC42 (0.46) | CDC42RAC1PTGS2PTGS1NPC1 | |
| SCHEMBL7875841 | 0.89 | CDC42 (0.46) | CDC42RAC1PTGS2PTGS1NPC1 | |
| SCHEMBL11201961 | 0.81 | ADRA2C (0.41) | NPC1CHRM3RAB9AALDH1A1KDM4E | |
| SCHEMBL11198170 | 0.78 | ALDH1A1 (0.36) | NPC1ALDH1A1KDM4EMAPTGAA | |
| SCHEMBL11203331 | 0.77 | ALDH1A1 (0.45) | NPC1RAB9AALDH1A1KDM4EMAPT | |
| SCHEMBL11194418 | 0.76 | ADRA2C (0.40) | ALDH1A1KDM4EMAPTTP53SMN1; SMN2 | |
| SCHEMBL30128755 | 0.75 | CDC42 (0.43) | CDC42RAC1PTGS2PTGS1NPC1 | |
| SCHEMBL11221534 | 0.74 | CYP3A4 (0.37) | RAB9AALDH1A1KDM4EMAPTGAA | |
| SCHEMBL7873890 | 0.74 | ALDH1A1 (0.37) | CDC42RAC1PTGS2PTGS1NPC1 |
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-4410534-A | 3-Substituted-5,6,7,8-tetrahydropyrrolo[1,2-a]-pyridine-and 6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]-azepine carboxylic acid derivatives useful as blood platelet aggregation inhibitors | SYNTEX (U.S.A.) INC. (US) | 1983-10-18 | — | — | US | disclosed |