Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21709146 | 0.80 | TSHR (0.36) | TSHR | |
| SCHEMBL21709141 | 0.79 | TSHR (0.35) | TSHR | |
| SCHEMBL21709191 | 0.71 | TSHR (0.39) | TSHR | |
| SCHEMBL9266373 | 0.70 | RXRA (0.45) | — | |
| SCHEMBL21709190 | 0.69 | HMGCR (0.40) | TSHRTDP1L3MBTL1 | |
| SCHEMBL7652171 | 0.68 | MAP3K14 (0.34) | — | |
| SCHEMBL9589157 | 0.65 | ALOX15 (0.50) | TSHR | |
| SCHEMBL18536578 | 0.65 | CNR1 (0.41) | TSHR | |
| SCHEMBL27699598 | 0.64 | HMGCR (0.36) | — | |
| SCHEMBL7519328 | 0.63 | TSHR (1.00) | TSHR |
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 |