Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
| ▸ | MAOA | P21397 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | BCHE | P06276 | 1/20 | 0.42 |
| ▸ | GRIN2D | O15399 | 4/20 | 0.41 |
| ▸ | GRIN3B | O60391 | 4/20 | 0.41 |
| ▸ | GRIN1 | Q05586 | 4/20 | 0.41 |
| ▸ | GRIN2A | Q12879 | 4/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 4/20 | 0.41 |
| ▸ | GRIN2C | Q14957 | 4/20 | 0.41 |
| ▸ | GRIN3A | Q8TCU5 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9703241 | 0.99 | KMT2A (0.48) | KMT2AMAOATSHRMAPK1CYP3A4 | |
| SCHEMBL9702719 | 0.89 | MAOA (0.47) | KMT2AMAOATSHRMAPK1MEN1 | |
| SCHEMBL9701989 | 0.80 | CHRM2 (0.39) | KMT2ALMNA | |
| Hydrochloric Acid SCHEMBL9702735 | 0.79 | CHRM2 (0.38) | KMT2ALMNA | |
| Hydrochloric Acid SCHEMBL9701984 | 0.77 | KCNN2 (0.52) | MAOAMAPK1CYP3A4CYP2C19GRIN2D | |
| SCHEMBL27841297 | 0.75 | KMT2A (0.56) | KMT2AMAOATSHRMAPK1MEN1 | |
| SCHEMBL17864729 | 0.75 | KMT2A (0.54) | KMT2AMAOATSHRMAPK1MEN1 | |
| SCHEMBL10903430 | 0.74 | MAOA (0.48) | KMT2AMAOATSHRMEN1BCHE | |
| SCHEMBL10642003 | 0.72 | MAOA (0.57) | KMT2AMAOATSHRMEN1BCHE | |
| SCHEMBL3383043 | 0.72 | KMT2A (0.62) | KMT2AMAOATSHRBCHEGRIN2D |
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 |
|---|---|---|---|---|---|---|---|
| WO-1992014465-A1 | USE OF ANNULATED TETRAHYDROPYRIDINACETIC ACID DERIVATES FOR TREATING NEUROLOGICAL DISEASES | BOEHRINGER INGELHEIM KG (DE) | 1992-09-03 | — | — | WO | disclosed |
| EP-0358957-A1 | Fused tetrahydropyridineacetic acid derivatives, process for their preparation, and use of such compounds for the cardioprotection | BOEHRINGER INGELHEIM KG (DE) | 1990-03-21 | — | — | EP | disclosed |