Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 4/20 | 0.78 |
| ▸ | NPC1 | O15118 | 2/20 | 0.75 |
| ▸ | RAB9A | P51151 | 2/20 | 0.75 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.75 |
| ▸ | JAK2 | O60674 | 1/20 | 0.75 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | GPX4 | P36969 | 1/20 | 0.55 |
| ▸ | LTB4R2 | Q9NPC1 | 5/20 | 0.50 |
| ▸ | MLYCD | O95822 | 1/20 | 0.50 |
| ▸ | ICMT | O60725 | 1/20 | 0.48 |
| ▸ | ALB | P02768 | 1/20 | 0.48 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.46 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.46 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL14229916 | 0.98 | TP53 (0.81) | TP53NPC1RAB9APAX8JAK2 | |
| SCHEMBL29266757 | 0.94 | NPC1 (0.75) | TP53NPC1RAB9APAX8JAK2 | |
| SCHEMBL3772286 | 0.93 | TP53 (0.83) | TP53NPC1RAB9APAX8JAK2 | |
| SCHEMBL9337705 | 0.89 | NPC1 (0.77) | TP53NPC1RAB9APAX8JAK2 | |
| SCHEMBL2069520 | 0.89 | TP53 (0.70) | TP53NPC1RAB9APAX8JAK2 | |
| SCHEMBL28330285 | 0.88 | NPC1 (0.76) | TP53NPC1RAB9APAX8JAK2 | |
| SCHEMBL5146433 | 0.87 | NPC1 (0.75) | TP53NPC1RAB9APAX8JAK2 | |
| SCHEMBL4164723 | 0.87 | TP53 (0.78) | TP53NPC1RAB9APAX8JAK2 | |
| SCHEMBL5146437 | 0.87 | NPC1 (0.75) | TP53NPC1RAB9APAX8JAK2 | |
| SCHEMBL14230004 | 0.86 | TP53 (0.89) | TP53NPC1RAB9APAX8JAK2 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |