Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | SHBG | P04278 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9140061 | 0.95 | EPHX2 (0.38) | CYP1A2SHBGTSHR | |
| SCHEMBL9134570 | 0.93 | TSHR (0.39) | CYP1A2TSHR | |
| SCHEMBL31347890 | 0.91 | TSHR (0.34) | TSHR | |
| SCHEMBL9136493 | 0.89 | SHBG (0.38) | CYP1A2SHBGTP53 | |
| SCHEMBL9134715 | 0.82 | SHBG (0.40) | SHBGTP53 | |
| SCHEMBL14472800 | 0.80 | SHBG (0.39) | CYP1A2SHBGTSHRTP53 | |
| SCHEMBL17904761 | 0.77 | SLC6A2 (0.33) | CYP1A2SHBGTSHR | |
| SCHEMBL9135559 | 0.77 | TP53 (0.36) | SHBGTP53 | |
| SCHEMBL16287272 | 0.76 | SHBG (0.41) | CYP1A2SHBGTSHR | |
| SCHEMBL16286782 | 0.76 | SHBG (0.41) | CYP1A2SHBGTSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-1043882-C | Propylene glycol cyclohexyl ether derivatives, method of producing same and uses thereof | ASAHI CHEMICAL IND (JP) | 1999-06-30 | — | — | CN | disclosed |
| US-5414144-A | Detergent, solvent, film-forming agent | ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) | 1995-05-09 | — | — | US | disclosed |
| CN-1100712-A | Propylene glycol cyclohexyl ether derivatives, method of producing same and uses thereof | ASAHI CHEMICAL IND (JP) | 1995-03-29 | — | — | CN | disclosed |