Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.55 |
| ▸ | NPC1 | O15118 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | MRGPRX4 | Q96LA9 | 4/20 | 0.49 |
| ▸ | TP53 | P04637 | 2/20 | 0.49 |
| ▸ | PKM | P14618 | 2/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.49 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.49 |
| ▸ | RELA | Q04206 | 2/20 | 0.49 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.49 |
| ▸ | PDE4A | P27815 | 1/20 | 0.48 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.48 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.48 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.48 |
| ▸ | ESR1 | P03372 | 1/20 | 0.47 |
| ▸ | THRA | P10827 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL14539034 | 0.90 | RAB9A (0.62) | RAB9ANPC1ALDH1A1ALOX5SMN1; SMN2 | |
| SCHEMBL6243823 | 0.85 | FFAR1 (0.53) | ALOX5MRGPRX4RXRAPTPRCPTPN1 | |
| SCHEMBL290279 | 0.84 | SLC7A5 (0.55) | RAB9ANPC1ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL27881288 | 0.84 | MAOB (0.65) | RAB9ANPC1ALDH1A1SMN1; SMN2MRGPRX4 | |
| SCHEMBL392863 | 0.83 | ALOX5 (0.66) | RAB9ANPC1ALDH1A1ALOX5SMN1; SMN2 | |
| SCHEMBL5271801 | 0.83 | MRGPRX4 (0.73) | RAB9ASMN1; SMN2MRGPRX4TP53PKM | |
| SCHEMBL12688088 | 0.82 | NPC1 (0.70) | RAB9ANPC1ALDH1A1ALOX5SMN1; SMN2 | |
| SCHEMBL28547278 | 0.81 | MAOB (0.70) | RAB9ANPC1ALDH1A1LMNAMAOB | |
| SCHEMBL6237900 | 0.80 | MAOB (0.50) | RAB9ANPC1ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL8037910 | 0.79 | ALOX5 (0.61) | RAB9ANPC1ALDH1A1ALOX5SMN1; SMN2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2005009104-A2 | BENZOIC AND PHENYL ACETIC ACID DERIVATIVES AS HNF-4 MODULATORS | LIGAND PHARMACUETICALS INCORPORATED (US) | 2005-02-03 | — | — | WO | disclosed |