Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | RAB9A | P51151 | 4/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.43 |
| ▸ | GPX4 | P36969 | 1/20 | 0.43 |
| ▸ | MLYCD | O95822 | 3/20 | 0.40 |
| ▸ | JAK2 | O60674 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14229452 | 0.92 | TP53 (0.50) | TP53ALDH1A1RAB9ANPC1PAX8 | |
| SCHEMBL14200993 | 0.85 | ALDH1A1 (0.41) | TP53ALDH1A1RAB9ANPC1PAX8 | |
| SCHEMBL14229061 | 0.83 | TP53 (0.48) | TP53ALDH1A1RAB9ANPC1PAX8 | |
| SCHEMBL14229440 | 0.82 | TP53 (0.47) | TP53ALDH1A1RAB9ANPC1PAX8 | |
| SCHEMBL14229445 | 0.81 | TP53 (0.62) | TP53ALDH1A1RAB9ANPC1PAX8 | |
| SCHEMBL14229243 | 0.79 | TP53 (0.56) | TP53ALDH1A1RAB9ANPC1PAX8 | |
| SCHEMBL14543593 | 0.78 | KMT2A (0.36) | TP53ALDH1A1RAB9ANPC1LMNA | |
| SCHEMBL14229121 | 0.77 | TP53 (0.69) | TP53ALDH1A1RAB9ANPC1PAX8 | |
| SCHEMBL14200996 | 0.77 | ALDH1A1 (0.38) | TP53ALDH1A1RAB9ANPC1PAX8 | |
| SCHEMBL14229218 | 0.76 | TP53 (0.51) | TP53ALDH1A1RAB9ANPC1PAX8 |
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 |