Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | KDM1A | O60341 | 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 | |
|---|---|---|---|---|
| SCHEMBL21708929 | 0.81 | — | — | |
| SCHEMBL21708863 | 0.80 | ALOX15 (0.31) | ALOX15ALOX12TSHR | |
| SCHEMBL21709154 | 0.80 | TSHR (0.30) | TSHR | |
| SCHEMBL21708868 | 0.76 | MAPT (0.41) | ALOX12TSHR | |
| SCHEMBL21709067 | 0.74 | KDM1A (0.34) | TSHRKDM1A | |
| SCHEMBL21709065 | 0.72 | MAOA (0.40) | TSHRKDM1A | |
| SCHEMBL21708850 | 0.67 | ALOX15 (0.42) | ALOX15ALOX12TSHR | |
| SCHEMBL11864900 | 0.65 | AOC3 (0.42) | KDM1A | |
| SCHEMBL11871569 | 0.65 | CYP1A2 (0.46) | — | |
| SCHEMBL21708928 | 0.65 | — | — |
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-2020032080-A1 | COMPOUND, SALT OF COMPOUND, NEUROMODULATION AGENT, METHOD FOR EVALUATING NEUROMODULATION AGENT, METHOD FOR PRODUCING COMPOUND, AND METHOD FOR PRODUCING SALT OF COMPOUND | 学校法人慶應義塾 | 2020-02-13 | — | — | WO | disclosed |