Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | KIF11 | P52732 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.39 |
| ▸ | EBP | Q15125 | 1/20 | 0.39 |
| ▸ | CASR | P41180 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.37 |
| ▸ | CCR1 | P32246 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27709750 | 0.82 | CCR1 (0.40) | KIF11SIGMAR1EBPTAAR1CCR1 | |
| SCHEMBL9557193 | 0.77 | HSP90AA1 (0.43) | ALDH1A1SMN1; SMN2KMT2ANPC1RAB9A | |
| SCHEMBL11825987 | 0.75 | TAAR1 (0.48) | SIGMAR1ALDH1A1SMN1; SMN2TAAR1 | |
| SCHEMBL9557665 | 0.73 | TAAR1 (0.48) | SIGMAR1ALDH1A1TAAR1KMT2AMEN1 | |
| SCHEMBL27709770 | 0.72 | EBP (0.41) | KIF11SIGMAR1EBPTAAR1TDP1 | |
| SCHEMBL9557143 | 0.72 | SMN1; SMN2 (0.42) | ALDH1A1SMN1; SMN2KMT2ANPC1RAB9A | |
| SCHEMBL3167357 | 0.71 | TAAR1 (0.48) | SIGMAR1CASRALDH1A1SMN1; SMN2TAAR1 | |
| SCHEMBL31174571 | 0.71 | LTA4H (0.49) | LTA4HKCNH2KIF11SIGMAR1CASR | |
| SCHEMBL17002514 | 0.69 | CA4 (0.50) | LTA4HKCNH2KIF11ALDH1A1NPC1 | |
| SCHEMBL3519606 | 0.69 | CA4 (0.50) | LTA4HKCNH2KIF11ALDH1A1NPC1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0251775-B1 | ALPHA-ARYL-ALPHA-PHENYLETHYL-1H-1,2,4-TRIAZOLE-1-PROPANENITRILES | ROHM AND HAAS COMPANY (US) | 1993-01-20 | — | — | EP | disclosed |
| US-5087635-A | Funcicides | ROHM AND HAAS COMPANY (US) | 1992-02-11 | — | — | US | disclosed |
| EP-0251775-A2 | Alpha-aryl-alpha-phenylethyl-1H-1,2,4-triazole-1-propanenitriles | ROHM AND HAAS COMPANY (US) | 1988-01-07 | — | — | EP | disclosed |