Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | TERT | O14746 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | DHFR | P00374 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ADK | P55263 | 1/20 | 0.34 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6826432 | 0.82 | MAPT (0.40) | HTTMAPTHPGDNPSR1LMNA | |
| SCHEMBL6829742 | 0.74 | MAPT (0.40) | MAPTHPGDLMNASMN1; SMN2RAB9A | |
| SCHEMBL6828829 | 0.73 | ALDH1A1 (0.45) | MAOAMAOBMAPTHPGDNPSR1 | |
| SCHEMBL6826409 | 0.73 | DAO (0.38) | MAOAMAOBMAPTHPGDLMNA | |
| SCHEMBL17508118 | 0.72 | MAOA (0.41) | MAOAMAOBHTTMAPTHPGD | |
| SCHEMBL6923000 | 0.71 | ALDH1A1 (0.42) | MAOAMAOBHTTMAPTHPGD | |
| SCHEMBL7131180 | 0.71 | MAOB (0.51) | MAOAMAOBHTTSMN1; SMN2NPC1 | |
| SCHEMBL29953723 | 0.70 | TERT (0.41) | MAOAMAOBHTTMAPTHPGD | |
| SCHEMBL23827443 | 0.68 | KMT2A (0.43) | MAPTHPGDLMNASMN1; SMN2NPC1 | |
| SCHEMBL28367550 | 0.66 | ACHE (0.50) | MAOAMAOBHTTMAPTHPGD |
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-2004037808-A1 | 2 - SUBSTITUTED HETEROCYCLIC COMPOUNDS AND ANTITUMOR COMPOSITION COMPRISING THE SAME | CHONG KUN DANG PHARMACEUTICAL CORP. (KR) | 2004-05-06 | — | — | WO | disclosed |