Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.40 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.40 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.40 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | PPM1B | O75688 | 1/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | PPP1CC | P36873 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7585065 | 1.00 | TP53 (0.44) | TP53CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL7585073 | 1.00 | TP53 (0.44) | TP53CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL7519060 | 1.00 | TP53 (0.44) | TP53CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL7772118 | 1.00 | TP53 (0.44) | TP53CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL8408358 | 1.00 | TP53 (0.44) | TP53CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL7772119 | 1.00 | TP53 (0.44) | TP53CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL15005440 | 0.94 | TP53 (0.44) | TP53CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL108455 | 0.94 | TP53 (0.44) | TP53CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL142778 | 0.94 | TP53 (0.44) | TP53CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL22657540 | 0.85 | TP53 (0.55) | TP53CHRNB2CHRNA4CHRNB4CHRNA3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0747336-B1 | Alkenyl cyclohexane derivatives and liquid crystal compositions | CHISSO CORP (JP) | 2001-07-25 | — | — | EP | disclosed |
| US-5709820-A | MIXTURES | CHISSO CORPORATION (JP) | 1998-01-20 | — | — | US | disclosed |
| EP-0747336-A1 | Alkenyl cyclohexane derivatives and liquid crystal compositions | Chisso Corporation (JP) | 1996-12-11 | — | — | EP | disclosed |