Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.61 |
| ▸ | RAB9A | P51151 | 2/20 | 0.61 |
| ▸ | PKM | P14618 | 1/20 | 0.61 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.61 |
| ▸ | MGAM | O43451 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.54 |
| ▸ | SI | P14410 | 1/20 | 0.54 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.54 |
| ▸ | PARP1 | P09874 | 1/20 | 0.51 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.47 |
| ▸ | DHODH | Q02127 | 3/20 | 0.44 |
| ▸ | C1R | P00736 | 1/20 | 0.44 |
| ▸ | PTGES | O14684 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | MET | P08581 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6887071 | 0.82 | ALDH1A1 (0.52) | NPC1ALDH1A1RAB9APKMGAA | |
| SCHEMBL31722934 | 0.81 | KDM4E (0.59) | NPC1ALDH1A1RAB9AMGAMGAA | |
| SCHEMBL11332812 | 0.81 | NPC1 (0.61) | NPC1ALDH1A1RAB9AL3MBTL1GAA | |
| SCHEMBL3111166 | 0.81 | KDM4E (0.59) | NPC1ALDH1A1RAB9AMGAMGAA | |
| SCHEMBL8623118 | 0.81 | PTGES (0.63) | NPC1ALDH1A1RAB9AMGAMGAA | |
| SCHEMBL8618963 | 0.78 | ALDH1A1 (0.56) | NPC1ALDH1A1RAB9AGAAPARP1 | |
| SCHEMBL8618978 | 0.77 | KDM4E (0.61) | NPC1ALDH1A1RAB9APKMMGAM | |
| SCHEMBL3722376 | 0.77 | PDE5A (0.58) | NPC1ALDH1A1RAB9APARP1C1R | |
| SCHEMBL2243125 | 0.76 | NPC1 (1.00) | NPC1ALDH1A1RAB9APKML3MBTL1 | |
| SCHEMBL31027904 | 0.76 | NPC1 (1.00) | NPC1ALDH1A1RAB9APKML3MBTL1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5849861-A | Polyquinazolines and methods for their preparation | HITACHI CHEMICAL CO., LTD. (JP) | 1998-12-15 | — | — | US | disclosed |
| US-5686560-A | TREATING A MONOMER WITH A BASE IN A DIPOLAR SOLVENT | HITACHI CHEMICAL CO., LTD. (JP) | 1997-11-11 | — | — | US | disclosed |