Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11869399 | 0.95 | CYP3A4 (0.49) | CYP3A4CYP2D6CYP2C9ALDH1A1KDM4E | |
| SCHEMBL11796254 | 0.92 | CYP3A4 (0.47) | CYP3A4CYP2D6CYP2C9ALDH1A1MAOB | |
| SCHEMBL1487480 | 0.88 | MEN1 (0.48) | CYP3A4CYP2D6CYP2C9ALDH1A1KDM4E | |
| SCHEMBL11788432 | 0.87 | CYP3A4 (0.49) | CYP3A4CYP2D6CYP2C9ALDH1A1KDM4E | |
| SCHEMBL10533050 | 0.85 | GAA (0.54) | CYP2D6CYP2C9ALDH1A1KDM4EHPGD | |
| SCHEMBL11803784 | 0.82 | ALDH1A1 (0.53) | ALDH1A1KDM4EHPGDMAOBKMT2A | |
| SCHEMBL11803780 | 0.82 | ALDH1A1 (0.53) | ALDH1A1KDM4EHPGDMAOBKMT2A | |
| SCHEMBL9292208 | 0.78 | CYP3A4 (0.51) | CYP3A4CYP2D6CYP2C9ALDH1A1KDM4E | |
| SCHEMBL11564421 | 0.77 | KDM4E (0.46) | CYP2C9ALDH1A1KDM4EHPGDMAOB | |
| SCHEMBL1130476 | 0.75 | CYP3A4 (0.55) | CYP3A4CYP2D6CYP2C9ALDH1A1KDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4291949-A | Positive-type display device using guest-host type mixture of liquid crystals and dyes | Wada, Masanobu (JP) | 1981-09-29 | — | — | US | disclosed |
| US-3966631-A | Nematic liquid crystal composition | HITACHI, LTD. (JA) | 1976-06-29 | — | — | US | disclosed |
| US-3963638-A | SULFONATES | EASTMAN KODAK COMPANY (US) | 1976-06-15 | — | — | US | disclosed |