Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | PSMB2 | P49721 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10501019 | 0.86 | MAOA (0.41) | NPC1RAB9AALDH1A1LMNAGSK3B | |
| SCHEMBL10501494 | 0.83 | KMT2A (0.36) | NPC1ALDH1A1SMN1; SMN2MAPTTSHR | |
| SCHEMBL9501160 | 0.83 | LMNA (0.36) | NPC1RAB9AALDH1A1SMN1; SMN2LMNA | |
| SCHEMBL9500876 | 0.75 | THRB (0.38) | NPC1RAB9APTGS2 | |
| SCHEMBL9504425 | 0.74 | NPBWR1 (0.35) | NPC1RAB9APTGS2ALDH1A1SMN1; SMN2 | |
| SCHEMBL6248177 | 0.73 | DDB1 (0.47) | NPC1RAB9APTGS2ALDH1A1LMNA | |
| SCHEMBL10733171 | 0.72 | HTR1A (0.36) | PTGS2ALDH1A1MAPT | |
| SCHEMBL9504429 | 0.72 | MEN1 (0.38) | LMNAMAPK1MAPT | |
| SCHEMBL9501084 | 0.71 | MEN1 (0.42) | LMNAMAPK1MAPT | |
| SCHEMBL9502415 | 0.67 | KMT2A (0.34) | ALDH1A1SMN1; SMN2LMNAMAPT |
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-0154885-B1 | SUBSTITUTED 2-PHENYL-HEXAHYDRO-1,2,4-TRIAZINE-2,5-DIONES, METHOD FOR THEIR PREPARATION, THEIR USE AS VETERINARY MEDICINES AND FOR COMBATING PROTOZOES | HOECHST AKTIENGESELLSCHAFT (DE) | 1989-01-18 | — | — | EP | disclosed |
| US-4640917-A | 2-phenyl-hexahydro-1,2,4-triazine-3,5-diones | HOECHST AKTIENGESELLSCHAFT (DE) | 1987-02-03 | — | — | US | disclosed |
| EP-0154885-A1 | Substituted 2-phenyl-hexahydro-1,2,4-triazine-2,5-diones, method for their preparation, their use as veterinary medicines and for combating protozoes | HOECHST AKTIENGESELLSCHAFT (DE) | 1985-09-18 | — | — | EP | disclosed |