Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | GMNN | O75496 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | DHODH | Q02127 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | SHBG | P04278 | 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 | |
|---|---|---|---|---|
| SCHEMBL7161388 | 0.82 | TSHR (0.50) | TP53KDM4EGMNNLMNAMAPT | |
| SCHEMBL9786408 | 0.81 | EPHX1 (0.36) | TP53EPHX1TDP1ALDH1A1NPSR1 | |
| SCHEMBL21099940 | 0.79 | ADRB2 (0.50) | TP53KDM4EGMNNLMNAMAPT | |
| SCHEMBL11384102 | 0.79 | EPHX1 (0.35) | TP53LMNAEPHX1TDP1ALDH1A1 | |
| SCHEMBL28955084 | 0.78 | TDP1 (0.37) | LMNAEPHX1TDP1ALDH1A1NPSR1 | |
| SCHEMBL8618781 | 0.78 | TDP1 (0.42) | TP53LMNAEPHX1TDP1ALDH1A1 | |
| SCHEMBL628290 | 0.77 | SHBG (0.39) | TP53EPHX1TDP1ALDH1A1NPSR1 | |
| SCHEMBL5273478 | 0.77 | ALDH1A1 (0.42) | TP53SMN1; SMN2EPHX1TDP1ALDH1A1 | |
| SCHEMBL14865128 | 0.76 | ADRB2 (0.44) | TP53KDM4EGMNNLMNAMAPT | |
| SCHEMBL9221270 | 0.75 | TP53 (0.52) | TP53KDM4EGMNNLMNAMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6600080-B1 | Method of alcohols such as cyclohexanedimethanol, a benzyl ester is obtained, for example, by the reaction between a benzyl compound and carboxylic acid in the presence of oxygen and a catalyst including palladium, gold ultra fine particles | NIPPON SHOKUBAI CO., LTD. (JP) | 2003-07-29 | — | — | US | disclosed |
| EP-1090902-A2 | Method for producing alcohols such as cyclohexanedimethanol | Nippon Shokubai Co., Ltd. (JP) | 2001-04-11 | — | — | EP | disclosed |