Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 7/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | EIF2AK2 | P19525 | 1/20 | 0.31 |
| ▸ | MMP13 | P45452 | 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 | |
|---|---|---|---|---|
| SCHEMBL9502409 | 0.85 | THRB (0.44) | THRBSLC6A4ALDH1A1CYP3A4TSHR | |
| SCHEMBL9500876 | 0.76 | THRB (0.38) | THRBSLC6A4SLC6A2SLC6A3RAB9A | |
| SCHEMBL10501699 | 0.71 | SLC6A4 (0.40) | SLC6A4SLC6A2SLC6A3HRH3MEN1 | |
| SCHEMBL9504425 | 0.71 | NPBWR1 (0.35) | SLC6A4ALDH1A1SLC6A2SLC6A3RAB9A | |
| SCHEMBL10502467 | 0.70 | NPC1 (0.40) | ALDH1A1TSHRMAPTRAB9A | |
| SCHEMBL10501494 | 0.69 | KMT2A (0.36) | ALDH1A1CYP3A4TSHRHPGDMEN1 | |
| SCHEMBL11452562 | 0.68 | THRB (0.80) | THRBSLC6A4 | |
| SCHEMBL11661452 | 0.67 | CYP3A4 (0.49) | THRBSLC6A4ALDH1A1CYP3A4TSHR | |
| SCHEMBL11455388 | 0.67 | ALDH1A1 (0.53) | THRBSLC6A4ALDH1A1CYP3A4TSHR | |
| SCHEMBL11456434 | 0.65 | L3MBTL1 (0.50) | THRBSLC6A4ALDH1A1MEN1MAPT |
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 |