Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 2/20 | 0.34 |
| ▸ | MAOB | P27338 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | KDM1A | O60341 | 4/20 | 0.33 |
| ▸ | RCOR1 | Q9UKL0 | 2/20 | 0.33 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.33 |
| ▸ | TUBB | P07437 | 1/20 | 0.33 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.33 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.33 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.33 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.33 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.33 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.33 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.33 |
| ▸ | TUBA3E | Q6PEY2 | 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 | |
|---|---|---|---|---|
| SCHEMBL6558248 | 0.87 | ALDH1A1 (0.44) | ALDH1A1MAOAMAOBKDM1ARCOR1 | |
| SCHEMBL6558265 | 0.82 | ALDH1A1 (0.38) | ALDH1A1NPC1RAB9AATMMAOA | |
| SCHEMBL6557103 | 0.80 | ALDH1A1 (0.37) | ALDH1A1RAB9AMAPK1SMN1; SMN2MEN1 | |
| SCHEMBL17860605 | 0.78 | RAB9A (0.45) | ALDH1A1NPC1RAB9AATMMAPK1 | |
| SCHEMBL2281435 | 0.78 | ALDH1A1 (0.42) | ALDH1A1MAOAMAOBSMN1; SMN2DRD2 | |
| SCHEMBL194639 | 0.77 | KDM1A (0.50) | ALDH1A1MAPK1KDM1ARCOR1DRD2 | |
| SCHEMBL29951214 | 0.75 | ALDH1A1 (0.56) | ALDH1A1NPC1RAB9AMAPK1TUBB4A | |
| SCHEMBL711416 | 0.75 | ALDH1A1 (0.56) | ALDH1A1NPC1RAB9AMAPK1TUBB4A | |
| SCHEMBL29995306 | 0.72 | DRD2 (0.42) | ALDH1A1NPC1RAB9AATMMAOA | |
| SCHEMBL6196036 | 0.72 | DRD2 (0.42) | ALDH1A1NPC1RAB9AATMMAOA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1392643-A2 | TRISUBSTITUTED-N- (1S)-1,2,3,4-TETRAHYDRO-1-NAPHTHALENYL] BENZAMIDES WHICH INHIBIT P2X3 AND P2X2/3 CONTAINING RECEPTORS | Abbott Laboratories (US) | 2004-03-03 | — | — | EP | disclosed |
| WO-2002094767-A2 | TRISUBSTITUTED-N-[(1S)-1,2,3,4-TETRAHYDRO-1-NAPHTHALENYL] BENZAMIDES WHICH INHIBIT P2X3 AND P2X2/3 CONTAINING RECEPTORS | ABBOTT LABORATORIES (US) | 2002-11-28 | — | — | WO | disclosed |