Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGKA | P23743 | 1/20 | 0.54 |
| ▸ | PAM | P19021 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 4/20 | 0.44 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | CES2 | O00748 | 1/20 | 0.44 |
| ▸ | CES1 | P23141 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | PRKCA | P17252 | 1/20 | 0.41 |
| ▸ | PRKCE | Q02156 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL698125 | 0.98 | — | — | |
| Cyclohexane SCHEMBL27791493 | 0.91 | DGKA (0.50) | DGKAPAMALDH1A1TP53TSHR | |
| SCHEMBL1044001 | 0.91 | DGKA (0.65) | DGKAPAMALDH1A1TSHRMAPT | |
| SCHEMBL2857061 | 0.89 | DGKA (0.69) | DGKAPAMALDH1A1TSHRMAPT | |
| SCHEMBL353797 | 0.89 | DGKA (0.69) | DGKAPAMALDH1A1TSHRMAPT | |
| SCHEMBL355177 | 0.89 | DGKA (0.69) | DGKAPAMALDH1A1TSHRMAPT | |
| SCHEMBL356145 | 0.89 | DGKA (0.69) | DGKAPAMALDH1A1TSHRMAPT | |
| SCHEMBL30979418 | 0.89 | DGKA (0.69) | DGKAPAMALDH1A1TSHRMAPT | |
| SCHEMBL10414846 | 0.89 | DGKA (0.69) | DGKAPAMALDH1A1TSHRMAPT | |
| SCHEMBL6266491 | 0.89 | DGKA (0.69) | DGKAPAMALDH1A1TSHRMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0796237-A1 | PREPARATION OF PENTENOIC ACID | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1997-09-24 | — | — | EP | claimed |
| WO-1996017817-A1 | PREPARATION OF PENTENOIC ACID | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1996-06-13 | — | — | WO | claimed |