Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | AMY1A | P0DUB6 | 4/20 | 0.37 |
| ▸ | ESR1 | P03372 | 2/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.33 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.33 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | GRIN2C | Q14957 | 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 | |
|---|---|---|---|---|
| SCHEMBL24549176 | 0.83 | HTT (0.43) | MAPTMEN1KMT2AALDH1A1AMY1A | |
| SCHEMBL7341936 | 0.81 | ACHE (0.39) | MAPTMEN1KMT2AALDH1A1ALOX5 | |
| SCHEMBL9306374 | 0.80 | CYP3A4 (0.41) | MAPTCYP3A4MEN1KMT2APTGS2 | |
| SCHEMBL7479157 | 0.78 | AAK1 (0.40) | MAPTCYP3A4ALDH1A1PTGS2ALOX5 | |
| SCHEMBL9306577 | 0.73 | ESR2 (0.42) | MAPTCYP3A4ALDH1A1PTGS2ALOX5 | |
| SCHEMBL941420 | 0.72 | HPGD (0.54) | CYP3A4MEN1KMT2AALDH1A1AMY1A | |
| SCHEMBL21723167 | 0.69 | MAPT (0.52) | MAPTCYP3A4MEN1KMT2AALDH1A1 | |
| SCHEMBL1191538 | 0.68 | AMY1A (0.46) | MAPTMEN1KMT2AALDH1A1AMY1A | |
| SCHEMBL7344628 | 0.68 | NUDT1 (0.41) | CYP3A4ALDH1A1NPC1RAB9AMGAM | |
| SCHEMBL7345385 | 0.68 | RAB9A (0.45) | MAPTMEN1KMT2AALDH1A1AMY1A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5347008-A | Thio(cyclo) alkanepolycarboxylic acids containing heterocyclic substituents | CIBA-GEIGY CORPORATION (US) | 1994-09-13 | — | — | US | disclosed |
| US-5152929-A | Corrosion inhibitors for water systems | CIBA-GEIGY CORPORATION (US) | 1992-10-06 | — | — | US | disclosed |
| EP-0129506-A2 | Heterocyclically substituted thio(cyclo)alkane polycarboxylic acids | CIBA-GEIGY AG (CH) | 1984-12-27 | — | — | EP | disclosed |