Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | GPX4 | P36969 | 1/20 | 0.46 |
| ▸ | JAK2 | O60674 | 1/20 | 0.38 |
| ▸ | TSPO | P30536 | 2/20 | 0.37 |
| ▸ | MLYCD | O95822 | 2/20 | 0.35 |
| ▸ | CNR2 | P34972 | 3/20 | 0.34 |
| ▸ | CNR1 | P21554 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14200778 | 0.91 | TP53 (0.39) | NPC1RAB9APAX8TP53ALDH1A1 | |
| SCHEMBL14200327 | 0.86 | NPC1 (0.46) | NPC1RAB9APAX8TP53ALDH1A1 | |
| SCHEMBL14200332 | 0.86 | ALDH1A1 (0.64) | NPC1RAB9APAX8TP53ALDH1A1 | |
| SCHEMBL14229218 | 0.83 | TP53 (0.51) | NPC1RAB9APAX8TP53ALDH1A1 | |
| SCHEMBL14200236 | 0.80 | NPC1 (0.60) | NPC1RAB9APAX8TP53ALDH1A1 | |
| SCHEMBL14200979 | 0.78 | NPC1 (0.41) | NPC1RAB9APAX8TP53ALDH1A1 | |
| SCHEMBL14200883 | 0.78 | ALDH1A1 (0.41) | NPC1RAB9APAX8TP53ALDH1A1 | |
| SCHEMBL14200993 | 0.78 | ALDH1A1 (0.41) | NPC1RAB9APAX8TP53ALDH1A1 | |
| SCHEMBL14200330 | 0.78 | MLYCD (0.44) | NPC1RAB9APAX8TP53JAK2 | |
| SCHEMBL14200376 | 0.78 | NPC1 (0.43) | NPC1RAB9APAX8TP53ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7365093-B2 | Endothelin antagonists | ABBOTT LABORATORIES (US) | 2008-04-29 | — | — | US | disclosed |
| US-7208517-B1 | Endothelin antagonists | ABBOTT LABORTORIES (US) | 2007-04-24 | — | — | US | disclosed |
| US-7208517-B1 | Endothelin antagonists | ABBOTT LABORTORIES (US) | 2007-04-24 | — | — | US | disclosed |