Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 2/20 | 0.49 |
| ▸ | RXFP1 | Q9HBX9 | 8/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.44 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.44 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.44 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.43 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6016381 | 0.84 | RXFP1 (0.56) | THRBRXFP1ALDH1A1MAPTNTRK1 | |
| SCHEMBL6016328 | 0.83 | RXFP1 (0.53) | THRBRXFP1KDM4EHPGDMAPT | |
| SCHEMBL6016535 | 0.83 | RXFP1 (0.50) | THRBRXFP1ALDH1A1MAPTNTRK1 | |
| SCHEMBL6016488 | 0.83 | RXFP1 (0.48) | THRBRXFP1ALDH1A1MAPTNTRK1 | |
| SCHEMBL6016460 | 0.82 | KDM4E (0.55) | ALDH1A1KDM4EHPGDMAPTSMN1; SMN2 | |
| SCHEMBL6016386 | 0.82 | RXFP1 (0.45) | THRBRXFP1ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL6016587 | 0.81 | MAPT (0.50) | THRBRXFP1ALDH1A1MAPTNTRK1 | |
| SCHEMBL6016541 | 0.80 | THRB (0.66) | THRBRXFP1MAPTNTRK1MEN1 | |
| Iodomethane SCHEMBL6016471 | 0.80 | KDM4E (0.52) | ALDH1A1KDM4EHPGDMAPTSMN1; SMN2 | |
| SCHEMBL6862421 | 0.80 | MEN1 (0.51) | THRBRXFP1ALDH1A1KDM4EHPGD |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1187815-B1 | 4-PHENYL-PYRIMIDINE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2006-02-08 | — | — | EP | disclosed |
| EP-1187815-A1 | 4-PHENYL-PYRIMIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2002-03-20 | — | — | EP | disclosed |
| US-6274588-B1 | NEUROKININ OR SUBSTANCE P ANTAGONISTS; CENTRAL NERVOUS SYSTEM AND PSYCHOLOGICAL DISORDES; ANTIDEPRESSANTS, ANXIOLYTIC AGENTS | HOFFMANN-LA ROCHE INC. | 2001-08-14 | — | — | US | disclosed |
| WO-2000073279-A1 | 4-PHENYL-PYRIMIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2000-12-07 | — | — | WO | disclosed |