Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.35 |
| ▸ | APP | P05067 | 4/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.32 |
| ▸ | PRKCE | Q02156 | 2/20 | 0.32 |
| ▸ | MYLK | Q15746 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | PRKCG | P05129 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | PRKCA | P17252 | 1/20 | 0.32 |
| ▸ | APEX1 | P27695 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL26137718 | 0.79 | TRPA1 (0.47) | ALDH1A1TDP1 | |
| SCHEMBL26137545 | 0.79 | IDO1 (0.37) | IDO1PRKCEMYLKMEN1ALDH1A1 | |
| SCHEMBL21756918 | 0.77 | GABRA1 (0.38) | GABRA1GABRB1GABRB2IDO1 | |
| SCHEMBL21756915 | 0.77 | GABRA1 (0.42) | GABRA1GABRB1GABRB2 | |
| SCHEMBL9684250 | 0.76 | PRKCE (0.38) | P2RX3PRKCEMYLKMEN1ALDH1A1 | |
| SCHEMBL21756923 | 0.76 | SLC6A4 (0.46) | GABRA1GABRB1GABRB2MEN1ALDH1A1 | |
| SCHEMBL21769672 | 0.75 | IDO1 (0.35) | APPIDO1PRKCEMYLKMEN1 | |
| SCHEMBL21756948 | 0.74 | SLC6A2 (0.38) | GABRA1GABRB1GABRB2APEX1 | |
| SCHEMBL23072809 | 0.73 | MEN1 (0.35) | APPIDO1PRKCEMYLKMEN1 | |
| SCHEMBL9968895 | 0.72 | GABRA1 (0.41) | GABRA1GABRB1GABRB2IDO1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020039092-A2 | NOVEL AROMATIC MOLECULES | Xeniopro GmbH (DE) | 2020-02-27 | — | — | WO | disclosed |