Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 3/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | CA7 | P43166 | 2/20 | 0.42 |
| ▸ | CA9 | Q16790 | 2/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL12948348 | 0.85 | L3MBTL1 (0.47) | IDO1TAAR1CA12CA1CA2 | |
| SCHEMBL31689794 | 0.83 | TAAR1 (0.50) | IDO1TAAR1CA12CA1CA2 | |
| SCHEMBL31689793 | 0.83 | TAAR1 (0.50) | IDO1TAAR1CA12CA1CA2 | |
| SCHEMBL83159 | 0.80 | IDO1 (0.57) | IDO1TAAR1CA12CA1CA2 | |
| SCHEMBL30951646 | 0.79 | IDO1 (0.42) | IDO1TAAR1CA12CA1CA2 | |
| SCHEMBL9860753 | 0.79 | IDO1 (0.42) | IDO1TAAR1CA12CA1CA2 | |
| SCHEMBL13696654 | 0.79 | IDO1 (0.42) | IDO1TAAR1CA12CA1CA2 | |
| SCHEMBL31366919 | 0.79 | IDO1 (0.42) | IDO1TAAR1CA12CA1CA2 | |
| SCHEMBL95872 | 0.79 | CA12 (0.53) | CA12CA1CA2CA14SMN1; SMN2 | |
| SCHEMBL607066 | 0.79 | TAAR1 (0.52) | IDO1TAAR1CA12CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1211921-A | Benzothiophenes, formulations containing same and process of preparing same | LILLY CO ELI (US) | 1999-03-24 | — | — | CN | disclosed |