Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 4/20 | 0.40 |
| ▸ | IDO1 | P14902 | 4/20 | 0.38 |
| ▸ | PGR | P06401 | 1/20 | 0.38 |
| ▸ | TDO2 | P48775 | 2/20 | 0.38 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 3/20 | 0.36 |
| ▸ | CTSL | P07711 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | VCP | P55072 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 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 | |
|---|---|---|---|---|
| SCHEMBL146573 | 0.96 | NPC1 (0.46) | NPC1RAB9ACES2CES1MAOB | |
| SCHEMBL321581 | 0.80 | CES2 (0.43) | NPC1RAB9ACES2CES1MAOB | |
| SCHEMBL30817696 | 0.79 | ALDH1A1 (0.52) | NPC1RAB9ACES2CES1MAOB | |
| SCHEMBL104151 | 0.78 | TTR (0.50) | NPC1RAB9ACES2CES1MAOB | |
| SCHEMBL31302316 | 0.78 | TTR (0.50) | NPC1RAB9ACES2CES1MAOB | |
| SCHEMBL9215548 | 0.78 | NPC1 (0.47) | NPC1RAB9ACES2CES1MAOB | |
| SCHEMBL10555693 | 0.78 | CES2 (0.45) | NPC1RAB9ACES2CES1MAOB | |
| SCHEMBL7683262 | 0.77 | MAPT (0.40) | NPC1CES2CES1ALDH1A1CA1 | |
| SCHEMBL29470947 | 0.77 | CES2 (0.67) | NPC1RAB9ACES2CES1ALDH1A1 | |
| SCHEMBL192962 | 0.77 | CES2 (0.67) | NPC1RAB9ACES2CES1ALDH1A1 |
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-1836174-A2 | ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS | AMGEN INC. (US) | 2007-09-26 | — | — | EP | disclosed |
| WO-2006039718-A2 | ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS | AMGEN INC (US) | 2006-04-13 | — | — | WO | disclosed |