Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAGLA | Q9Y4D2 | 4/20 | 0.48 |
| ▸ | FAAH | O00519 | 2/20 | 0.48 |
| ▸ | CES1 | P23141 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | TP53 | P04637 | 3/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | GFER | P55789 | 1/20 | 0.42 |
| ▸ | XDH | P47989 | 2/20 | 0.40 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5945965 | 0.81 | RAB9A (0.42) | FAAHCES1NPC1MAPTSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL3621157 | 0.80 | RAB9A (0.41) | FAAHCES1NPC1MAPTSMN1; SMN2 | |
| SCHEMBL6468184 | 0.72 | CES1 (0.46) | FAAHCES1KDM4EHPGDGRM2 | |
| SCHEMBL7414987 | 0.72 | CES1 (0.46) | FAAHCES1KDM4EHPGDGRM2 | |
| SCHEMBL7412637 | 0.71 | NPC1 (0.38) | DAGLAFAAHCES1NPC1MAPT | |
| SCHEMBL28280910 | 0.70 | RAB9A (0.70) | DAGLAFAAHCES1NPC1MAPT | |
| SCHEMBL30583226 | 0.70 | NPC1 (0.70) | DAGLAFAAHCES1NPC1MAPT | |
| SCHEMBL23207497 | 0.69 | MAPT (0.47) | NPC1MAPTSMN1; SMN2RAB9ATP53 | |
| SCHEMBL29639834 | 0.69 | MAPT (0.47) | NPC1MAPTSMN1; SMN2RAB9ATP53 | |
| SCHEMBL7049306 | 0.69 | DAGLA (0.44) | DAGLAFAAHCES1NPC1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-1999042439-A1 | NOVEL THIOBENZAMIDES | ROCHE DIAGNOSTICS GMBH (DE) | 1999-08-26 | — | — | WO | claimed |
| EP-1161422-A1 | AMINE DERIVATIVES AS PROTEASE INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2001-12-12 | — | — | EP | disclosed |
| WO-2000055144-A1 | AMINE DERIVATIVES AS PROTEASE INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2000-09-21 | — | — | WO | disclosed |