Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | TSPO | P30536 | 1/20 | 0.36 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.35 |
| ▸ | MLYCD | O95822 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2537839 | 0.83 | ALDH1A1 (0.46) | ALDH1A1TSHRMEN1KMT2AL3MBTL1 | |
| SCHEMBL690247 | 0.81 | ALDH1A1 (0.53) | ALDH1A1TSHRMEN1KMT2AL3MBTL1 | |
| Ammonia Solution, Strong SCHEMBL10539922 | 0.79 | ALDH1A1 (0.52) | ALDH1A1TSHRMEN1KMT2AL3MBTL1 | |
| SCHEMBL10536986 | 0.79 | ALDH1A1 (0.52) | ALDH1A1TSHRMEN1KMT2AL3MBTL1 | |
| SCHEMBL900235 | 0.78 | TSHR (0.38) | ALDH1A1TSHRMEN1KMT2AL3MBTL1 | |
| SCHEMBL27539918 | 0.75 | CRHBP (0.40) | ALDH1A1TSHRMEN1KMT2AGLA | |
| SCHEMBL10541378 | 0.75 | ALDH1A1 (0.47) | ALDH1A1TSHRMEN1KMT2AL3MBTL1 | |
| SCHEMBL2235493 | 0.74 | SMN1; SMN2 (0.42) | ALDH1A1KMT2ATSPO | |
| Isopropylamine SCHEMBL10539711 | 0.73 | ALDH1A1 (0.46) | ALDH1A1TSHRMEN1KMT2AL3MBTL1 | |
| SCHEMBL10540499 | 0.73 | ALDH1A1 (0.46) | ALDH1A1TSHRMEN1KMT2AL3MBTL1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1073624-A1 | AMINOMETHYL-BENZOIC ESTER DERIVATIVES AS TRYPTASE INHIBITORS | Proteus Molecular Design Limited (GB) | 2001-02-07 | — | — | EP | disclosed |
| WO-1999055661-A1 | AMINOMETHYL-BENZOIC ESTER DERIVATIVES AS TRYPTASE INHIBITORS | PROTEUS MOLECULAR DESIGN LIMITED (GB) | 1999-11-04 | — | — | WO | disclosed |