Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | GRM5 | P41594 | 1/20 | 0.32 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | TNKS | O95271 | 3/20 | 0.30 |
| ▸ | TNKS2 | Q9H2K2 | 3/20 | 0.30 |
| ▸ | PARP1 | P09874 | 1/20 | 0.30 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.30 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.30 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.30 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.30 |
| ▸ | CYP1B1 | Q16678 | 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 | |
|---|---|---|---|---|
| SCHEMBL10429350 | 0.85 | KDR (0.36) | ALDH1A1HPGDTNKSTNKS2PARP1 | |
| SCHEMBL10429322 | 0.85 | ALDH1A1 (0.37) | NPC1RAB9AKDM4EGRM5GRM1 | |
| SCHEMBL2121780 | 0.85 | NPSR1 (0.40) | NPC1POLBRAB9AATMKDM4E | |
| Hydrochloric Acid SCHEMBL10429329 | 0.84 | KDR (0.35) | ALDH1A1HPGDPDE3BPDE3A | |
| SCHEMBL10429361 | 0.83 | MAOB (0.36) | NPC1POLBRAB9AKDM4EPKM | |
| SCHEMBL10429313 | 0.83 | NOTUM (0.38) | POLBKDM4EALDH1A1HPGDKMT2A | |
| SCHEMBL10429367 | 0.82 | HPGD (0.47) | NPC1POLBRAB9AKDM4EALDH1A1 | |
| SCHEMBL10429337 | 0.81 | XDH (0.40) | PKMALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL10429340 | 0.78 | NOTUM (0.39) | NPC1RAB9AKDM4EALDH1A1HPGD | |
| SCHEMBL10429304 | 0.78 | SMN1; SMN2 (0.43) | NPC1POLBRAB9AKDM4EALDH1A1 |
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-0274654-A2 | 1,2,3-Triazin-4(3H)-one derivatives, process for their preparation and medicaments containing them | F. HOFFMANN-LA ROCHE AG (CH) | 1988-07-20 | — | — | EP | claimed |
| US-4920119-A | XANTHINE OXIDASE INHIBITORS; CONTROL OR PREVENTION OF GOUT OR ISCHEMIA | HOFFMANN-LA ROCHE INC. (US) | 1990-04-24 | — | — | US | disclosed |
| EP-0274654-A2 | 1,2,3-Triazin-4(3H)-one derivatives, process for their preparation and medicaments containing them | F. HOFFMANN-LA ROCHE AG (CH) | 1988-07-20 | — | — | EP | disclosed |