Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H3 | Q13133 | 4/20 | 0.45 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.45 |
| ▸ | TGM2 | P21980 | 1/20 | 0.40 |
| ▸ | TGM1 | P22735 | 1/20 | 0.40 |
| ▸ | CASP3 | P42574 | 1/20 | 0.40 |
| ▸ | TGM3 | Q08188 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | AVPR1B | P47901 | 7/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6582815 | 0.90 | NR1H3 (0.47) | NR1H3NR1H2TGM2TGM1CASP3 | |
| SCHEMBL6580841 | 0.84 | NR1H3 (0.43) | NR1H3NR1H2TGM2TGM1CASP3 | |
| SCHEMBL6580598 | 0.83 | NR1H3 (0.47) | NR1H3NR1H2TGM2TGM1CASP3 | |
| Hydrochloric Acid SCHEMBL6581513 | 0.82 | NR1H3 (0.46) | NR1H3NR1H2TGM2TGM1CASP3 | |
| SCHEMBL6581649 | 0.80 | NR1H2 (0.51) | NR1H3NR1H2HSD17B10KDM4ENPC1 | |
| SCHEMBL17280134 | 0.80 | NR1H3 (0.57) | NR1H3NR1H2TGM2TGM1CASP3 | |
| SCHEMBL6581299 | 0.73 | NR1H2 (0.45) | NR1H3NR1H2TGM2TGM1CASP3 | |
| SCHEMBL6578579 | 0.72 | NR1H3 (0.49) | NR1H3NR1H2CASP3AVPR1BHSD17B10 | |
| SCHEMBL6580805 | 0.72 | TGM2 (0.51) | NR1H3NR1H2TGM2TGM1CASP3 | |
| Hydrochloric Acid SCHEMBL6581321 | 0.72 | NR1H3 (0.48) | NR1H3NR1H2CASP3AVPR1BHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1070708-B1 | Triazole derivatives | HOFFMANN LA ROCHE (CH) | 2004-01-14 | — | — | EP | claimed |