Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 4/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.36 |
| ▸ | LTA4H | P09960 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | GBA1 | P04062 | 2/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.33 |
| ▸ | CHRNA5 | P30532 | 2/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7635766 | 0.79 | CACNA1B (0.41) | USP2ALDH1A1SMN1; SMN2MAPTHTT | |
| SCHEMBL7635971 | 0.75 | MAPT (0.46) | CYP11B1CYP11B2SMN1; SMN2NPC1MAPT | |
| SCHEMBL7996172 | 0.75 | CYP11B1 (0.34) | CYP11B1CYP11B2CYP19A1CHRNB2CHRNA5 | |
| SCHEMBL8002213 | 0.73 | CYP11B1 (0.37) | USP2ALDH1A1CYP11B1CYP11B2SMN1; SMN2 | |
| SCHEMBL7630028 | 0.71 | ABCB1 (0.36) | ALDH1A1MAPTHTTCYP3A4CYP2D6 | |
| SCHEMBL7630588 | 0.68 | TSHR (0.42) | ALDH1A1SMN1; SMN2NPC1MAPTHTT | |
| SCHEMBL7238638 | 0.66 | CACNA1B (0.41) | USP2ALDH1A1SMN1; SMN2HTTCYP19A1 | |
| SCHEMBL7631313 | 0.65 | MAPT (0.45) | CYP11B1CYP11B2SMN1; SMN2NPC1MAPT | |
| SCHEMBL7233535 | 0.65 | CACNA1B (0.42) | ALDH1A1MAPTCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL7239115 | 0.63 | MAPT (0.46) | CYP11B1CYP11B2SMN1; SMN2NPC1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001072740-A1 | SUBSTITUTED 1-(4-AMINOPHENYL) TRIAZOLES AND THEIR USE AS ANTI-INFLAMMATORY AGENTS | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) | 2001-10-04 | — | — | WO | claimed |