Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.52 |
| ▸ | NPC1 | O15118 | 3/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 5/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | CRHBP | P24387 | 1/20 | 0.45 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.44 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL5204610 | 0.87 | RAB9A (0.53) | RAB9ANPC1CYP3A4CYP1A2CYP2D6 | |
| SCHEMBL11713988 | 0.82 | LMNA (0.49) | CYP3A4CYP1A2CYP2C9CYP2C19LMNA | |
| SCHEMBL10740536 | 0.82 | RAB9A (0.51) | RAB9ANPC1CYP3A4CYP1A2CYP2D6 | |
| SCHEMBL12053329 | 0.77 | CYP3A4 (0.55) | RAB9ANPC1CYP3A4CYP1A2CYP2D6 | |
| SCHEMBL9554755 | 0.77 | ALDH2 (0.50) | RAB9ANPC1CYP3A4CYP1A2CYP2D6 | |
| SCHEMBL11717988 | 0.77 | FAAH (0.49) | RAB9ANPC1CYP3A4LMNAMAPT | |
| SCHEMBL9294459 | 0.77 | NPC1 (0.46) | RAB9ANPC1CYP3A4CYP1A2CYP2D6 | |
| SCHEMBL4758947 | 0.76 | LMNA (0.65) | RAB9ANPC1CYP3A4LMNAMAPT | |
| SCHEMBL11711873 | 0.76 | TDP1 (0.56) | NPC1LMNAMAPTL3MBTL1SMN1; SMN2 | |
| SCHEMBL5533520 | 0.76 | ALDH1A1 (0.66) | RAB9ANPC1CYP3A4CYP1A2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-4056628-A | Insecticidal esters of alpha-phenoxy alkanoic acids with substituted benzyl alcohols | HOFFMANN-LA ROCHE INC. (US) | 1977-11-01 | — | — | US | disclosed |