Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNN2 | Q9H2S1 | 4/20 | 0.50 |
| ▸ | KCNN3 | Q9UGI6 | 4/20 | 0.50 |
| ▸ | KCNN1 | Q92952 | 2/20 | 0.50 |
| ▸ | MTNR1B | P49286 | 4/20 | 0.48 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.43 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.43 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.43 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.43 |
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 SCHEMBL9700855 | 0.99 | KCNN2 (0.51) | KCNN2KCNN3KCNN1MTNR1BMAOA | |
| Hydrochloric Acid SCHEMBL9701984 | 0.88 | KCNN2 (0.52) | KCNN2KCNN3KCNN1MTNR1BMAOA | |
| Hydrochloric Acid SCHEMBL5075032 | 0.82 | KCNN2 (0.57) | KCNN2KCNN3KCNN1MAOAABCB1 | |
| SCHEMBL9701768 | 0.78 | MTNR1B (0.49) | MTNR1BTP53ALDH1A1LMNAGRIN2C | |
| Hydrochloric Acid SCHEMBL5073427 | 0.77 | MAOA (0.58) | KCNN2KCNN3KCNN1MAOAKDM4E | |
| SCHEMBL9702719 | 0.76 | MAOA (0.47) | MAOAALDH1A1LMNAMAPK1GRIN2D | |
| SCHEMBL17864728 | 0.74 | SLC18A2 (0.52) | KCNN2KCNN3KCNN1MTNR1BMAOA | |
| SCHEMBL13602136 | 0.74 | MAOA (0.63) | KCNN2KCNN3KCNN1MAOAKDM4E | |
| Hydrochloric Acid SCHEMBL10706878 | 0.73 | MAOA (0.59) | KCNN2KCNN3KCNN1MAOAKDM4E | |
| SCHEMBL17864726 | 0.70 | KCNN2 (0.51) | KCNN2KCNN3KCNN1MAOATP53 |
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 |