Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 3/20 | 0.51 |
| ▸ | NR1H3 | Q13133 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | TEK | Q02763 | 1/20 | 0.46 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 4/20 | 0.44 |
| ▸ | RAB9A | P51151 | 4/20 | 0.44 |
| ▸ | TP53 | P04637 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.43 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.42 |
| ▸ | CDK4 | P11802 | 1/20 | 0.42 |
| ▸ | CCND1 | P24385 | 1/20 | 0.42 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.42 |
| ▸ | CDK2 | P24941 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5678433 | 0.86 | NR1H2 (0.64) | NR1H2NR1H3TEKADORA2AADORA1 | |
| SCHEMBL6861707 | 0.81 | ALDH1A1 (0.57) | NPC1RAB9AALDH1A1MAPTLMNA | |
| SCHEMBL15025693 | 0.79 | NR1H2 (0.73) | NR1H2NR1H3KDM4EADORA2AADORA3 | |
| SCHEMBL3500575 | 0.79 | NR1H2 (0.68) | NR1H2NR1H3TEKADORA2ANPC1 | |
| SCHEMBL29366389 | 0.79 | NR1H2 (0.68) | NR1H2NR1H3TEKADORA2ANPC1 | |
| SCHEMBL15117068 | 0.78 | KDM4E (0.67) | NR1H2NR1H3KDM4EADORA2ANPC1 | |
| SCHEMBL5681247 | 0.77 | TRPA1 (0.40) | KDM4ETEKADORA2ANPC1RAB9A | |
| SCHEMBL13675365 | 0.76 | ABL1 (0.56) | KDM4ETEKNPC1RAB9ATP53 | |
| SCHEMBL8513868 | 0.76 | NR1H2 (0.53) | NR1H2NR1H3KDM4EADORA2AADORA3 | |
| SCHEMBL10943615 | 0.75 | NR1H2 (0.63) | NR1H2NR1H3ADORA2AADORA1LMNA |
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-6797722-B2 | Use of 3-(2-ethylphenyl)-5-(3-methoxyphenyl)-1H-1,2,4-triazole for the treatment of autoimmune diseases | SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) | 2004-09-28 | — | — | US | disclosed |