Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.59 |
| ▸ | BCHE | P06276 | 2/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.58 |
| ▸ | HPGD | P15428 | 4/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.58 |
| ▸ | LMNA | P02545 | 2/20 | 0.58 |
| ▸ | GAA | P10253 | 3/20 | 0.58 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.58 |
| ▸ | MEN1 | O00255 | 3/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.56 |
| ▸ | CA12 | O43570 | 1/20 | 0.55 |
| ▸ | CA1 | P00915 | 1/20 | 0.55 |
| ▸ | CA2 | P00918 | 1/20 | 0.55 |
| ▸ | CA9 | Q16790 | 1/20 | 0.55 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL20538344 | 1.00 | HTT (0.59) | HTTBCHEALDH1A1HPGDKDM4E | |
| SCHEMBL20538144 | 0.95 | ALDH1A1 (0.56) | HTTBCHEALDH1A1HPGDKDM4E | |
| SCHEMBL20538142 | 0.95 | ALDH1A1 (0.56) | HTTBCHEALDH1A1HPGDKDM4E | |
| SCHEMBL20538140 | 0.95 | ALDH1A1 (0.56) | HTTBCHEALDH1A1HPGDKDM4E | |
| SCHEMBL20537918 | 0.94 | MEN1 (0.58) | HTTBCHEALDH1A1HPGDKDM4E | |
| SCHEMBL20537835 | 0.94 | MMP1 (0.61) | HTTBCHEALDH1A1HPGDKDM4E | |
| SCHEMBL20537837 | 0.94 | MMP1 (0.61) | HTTBCHEALDH1A1HPGDKDM4E | |
| SCHEMBL19801022 | 0.94 | MEN1 (0.58) | HTTBCHEALDH1A1HPGDKDM4E | |
| SCHEMBL20538022 | 0.94 | HDAC3 (0.59) | HTTBCHEALDH1A1HPGDKDM4E | |
| SCHEMBL20538020 | 0.94 | HDAC3 (0.59) | HTTBCHEALDH1A1HPGDKDM4E |
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-3183230-B1 | N-((3,4,5-TRIMETHOXYSTYRYL)ARYL)CINNAMAMIDE COMPOUNDS AS POTENTIAL ANTICANCER AGENTS AND PROCESS FOR THE PREPARATION THEREOF | COUNCIL SCIENT IND RES (IN) | 2018-10-24 | — | — | EP | claimed |