Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
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 SCHEMBL5842390 | 0.99 | MEN1 (0.56) | MEN1KMT2ASIGMAR1TSHRHTT | |
| SCHEMBL5840932 | 0.89 | CACNA1G (0.60) | SIGMAR1LMNATP53 | |
| SCHEMBL6987296 | 0.89 | ALDH1A1 (0.54) | SIGMAR1LMNAALDH1A1 | |
| SCHEMBL6986958 | 0.89 | SMN1; SMN2 (0.54) | KMT2AHTTLMNATP53ALDH1A1 | |
| SCHEMBL6978967 | 0.89 | LMNA (0.53) | KMT2ASIGMAR1LMNACYP2C19TP53 | |
| SCHEMBL6987557 | 0.89 | HTR1A (0.52) | SIGMAR1HRH3CA1CA2CA9 | |
| SCHEMBL6980711 | 0.89 | MAPT (0.57) | KMT2ATP53HRH3ALDH1A1 | |
| Hydrochloric Acid SCHEMBL5842633 | 0.88 | SMN1; SMN2 (0.56) | KMT2AHTTLMNATP53ALDH1A1 | |
| Hydrochloric Acid SCHEMBL5842876 | 0.88 | KMT2A (0.55) | MEN1KMT2ASIGMAR1TSHRLMNA | |
| Hydrochloric Acid SCHEMBL5842086 | 0.88 | HTR1A (0.53) | HRH3CA1CA2CA9ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1275647-B1 | Octahydro-2H-pyrido[1,2-a]pyrazine derivatives, process for their preparation and pharmaceutical compositions containing them | SERVIER LAB (FR) | 2003-11-12 | — | — | EP | disclosed |