Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | NPC1 | O15118 | 4/20 | 0.34 |
| ▸ | RAB9A | P51151 | 4/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | DHODH | Q02127 | 1/20 | 0.32 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.32 |
| ▸ | WNT3A | P56704 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL22639071 | 0.81 | NPC1 (0.39) | PTPN1KDM4EHPGDMAPTHSD17B3 | |
| SCHEMBL22639077 | 0.78 | DHODH (0.34) | MAPTALDH1A1LMNAGAADHODH | |
| SCHEMBL22639070 | 0.72 | DNMT1 (0.39) | KDM4EHPGDMAPTALDH1A1NPC1 | |
| SCHEMBL25686093 | 0.70 | ALDH1A1 (0.55) | KDM4EHPGDMAPTHSD17B3ALDH1A1 | |
| SCHEMBL22639062 | 0.69 | KDM4E (0.37) | KDM4EHPGDALDH1A1LMNAGAA | |
| SCHEMBL28506677 | 0.68 | HPGD (0.39) | PTPN1KDM4EHPGDMAPTALDH1A1 | |
| SCHEMBL1121674 | 0.65 | NPC1 (0.53) | HPGDMAPTHSD17B3ALDH1A1NPC1 | |
| SCHEMBL21119057 | 0.65 | ACMSD (0.55) | HPGDMAPTALDH1A1NPC1RAB9A | |
| SCHEMBL30989232 | 0.65 | ACMSD (0.55) | HPGDMAPTALDH1A1NPC1RAB9A | |
| SCHEMBL12254059 | 0.64 | KDM4E (0.44) | KDM4EHPGDALDH1A1LMNAGAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020226532-A1 | SUBSTITUTED 3,4,12,12A-TETRAHYDRO-1H-[1,4]OXAZINO[3,4-C]PYRIDO[2,1-F][1,2,4]TRIAZINE-6,8-DIONE, PHARMACEUTICAL COMPOSITION, AND METHODS FOR PREPARING AND USING SAME | ИВАЩЕНКО, Александр Васильевич | 2020-11-12 | — | — | WO | disclosed |