Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | NAAA | Q02083 | 1/20 | 0.41 |
| ▸ | CTSL | P07711 | 2/20 | 0.39 |
| ▸ | CTSB | P07858 | 2/20 | 0.39 |
| ▸ | CTSK | P43235 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 4/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | CA7 | P43166 | 2/20 | 0.38 |
| ▸ | CA9 | Q16790 | 2/20 | 0.38 |
| ▸ | TACR1 | P25103 | 2/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | LTA4H | P09960 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19713285 | 0.80 | TSHR (0.56) | TSHRNAAACYP2C19HTTSMN1; SMN2 | |
| SCHEMBL14139311 | 0.79 | TSHR (0.47) | TSHRNAAACTSLCTSBCTSK | |
| SCHEMBL30868576 | 0.79 | TSHR (0.47) | TSHRNAAACTSLCTSBCTSK | |
| SCHEMBL31567153 | 0.79 | TSHR (0.42) | TSHRNAAACTSLCTSBCTSK | |
| SCHEMBL2628026 | 0.78 | TSHR (0.45) | TSHRNAAACTSLCTSBCTSK | |
| SCHEMBL3648830 | 0.77 | TSHR (0.52) | TSHRNAAACTSLCTSBCTSK | |
| SCHEMBL5447262 | 0.76 | TSHR (0.56) | TSHRNAAACTSLCTSBCTSK | |
| SCHEMBL28855532 | 0.76 | TSHR (0.42) | TSHRNAAACTSLCTSBCTSK | |
| SCHEMBL10970522 | 0.75 | TSHR (0.50) | TSHRNAAACTSLCTSBCTSK | |
| SCHEMBL17710656 | 0.74 | CTSS (0.43) | TSHRNAAACTSLCTSBCTSK |
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 |
|---|---|---|---|---|---|---|---|
| US-4730006-A | BACTERICIDES | MERRELL DOW PHARMACEUTICALS INC. (US) | 1988-03-08 | — | — | US | disclosed |