Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 3/20 | 0.56 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | GPX4 | P36969 | 1/20 | 0.50 |
| ▸ | JAK2 | O60674 | 1/20 | 0.46 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.42 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.42 |
| ▸ | OGG1 | O15527 | 1/20 | 0.41 |
| ▸ | LTB4R2 | Q9NPC1 | 2/20 | 0.41 |
| ▸ | MLYCD | O95822 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14229264 | 0.91 | TP53 (0.59) | TP53NPC1RAB9APAX8ALDH1A1 | |
| SCHEMBL4600519 | 0.85 | MTNR1A (0.47) | TP53NPC1RAB9APAX8ALDH1A1 | |
| SCHEMBL22350387 | 0.85 | TP53 (0.47) | TP53NPC1RAB9APAX8ALDH1A1 | |
| SCHEMBL14200819 | 0.85 | TP53 (0.47) | TP53NPC1RAB9APAX8ALDH1A1 | |
| SCHEMBL14229121 | 0.84 | TP53 (0.69) | TP53NPC1RAB9APAX8ALDH1A1 | |
| SCHEMBL27955327 | 0.83 | ALDH1A1 (0.48) | TP53NPC1RAB9APAX8ALDH1A1 | |
| SCHEMBL14229681 | 0.83 | TP53 (0.56) | TP53NPC1RAB9APAX8ALDH1A1 | |
| SCHEMBL14229341 | 0.83 | LTB4R2 (0.58) | TP53NPC1RAB9APAX8ALDH1A1 | |
| SCHEMBL14230160 | 0.82 | TP53 (0.55) | TP53NPC1RAB9APAX8ALDH1A1 | |
| SCHEMBL14230018 | 0.82 | TP53 (0.68) | TP53NPC1RAB9APAX8ALDH1A1 |
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 |