Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.31 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8654484 | 0.84 | CYP1A2 (0.42) | CYP1A2MCL1GRM1CA12CA1 | |
| SCHEMBL10423079 | 0.79 | PARP1 (0.30) | — | |
| SCHEMBL6132208 | 0.75 | ACE2 (0.36) | CYP1A2GRM1ACE2 | |
| SCHEMBL4041905 | 0.72 | ALDH1A1 (0.48) | MCL1CA12CA1CA2CA7 | |
| SCHEMBL788898 | 0.71 | ACE2 (0.44) | CYP1A2MCL1GRM1CA12CA1 | |
| SCHEMBL8921442 | 0.71 | HSD17B10 (0.43) | CYP1A2CA12CA1CA2CA7 | |
| SCHEMBL10797196 | 0.71 | HSD17B10 (0.47) | CYP1A2 | |
| SCHEMBL11216320 | 0.70 | ACE2 (0.39) | CYP1A2GRM1CA12CA1CA2 | |
| SCHEMBL5695480 | 0.70 | ACE2 (0.39) | CYP1A2GRM1CA12CA1CA2 | |
| SCHEMBL6132238 | 0.69 | ACE2 (0.36) | CYP1A2GRM1ACE2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0053024-B1 | PROCESS FOR PRODUCING OLIGOESTERS | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 1985-02-13 | — | — | EP | disclosed |