Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | MC4R | P32245 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | PPARG | P37231 | 1/20 | 0.31 |
| ▸ | PPARA | Q07869 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL9595609 | 0.99 | CYP2D6 (0.35) | CYP2D6TSHRMEN1KMT2ACYP2C19 | |
| SCHEMBL9641212 | 0.85 | HRH3 (0.34) | CYP2D6TSHRMEN1KMT2AGAA | |
| Bromide SCHEMBL9595283 | 0.84 | HRH3 (0.33) | CYP2D6TSHRMEN1KMT2AGAA | |
| SCHEMBL9640312 | 0.83 | TSHR (0.34) | TSHRMEN1KMT2ASIGMAR1MC4R | |
| SCHEMBL9640355 | 0.83 | LMNA (0.34) | GAALMNASMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL27814642 | 0.82 | LMNA (0.43) | CYP2D6TSHRKMT2ACYP2C19LMNA | |
| Bromide SCHEMBL9595302 | 0.82 | TSHR (0.33) | TSHRMEN1KMT2ASIGMAR1POLB | |
| SCHEMBL2805436 | 0.79 | CCR2 (0.39) | CYP2D6TSHRMEN1KMT2ACYP2C19 | |
| Trichloroacetic Acid SCHEMBL27834532 | 0.77 | LMNA (0.39) | CYP2D6TSHRKMT2ALMNASMN1; SMN2 | |
| SCHEMBL2353804 | 0.77 | PARP1 (0.40) | CYP2D6MEN1KMT2AGAAALDH1A1 |
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-0288394-B1 | 1,2,5,6-TETRAHYDROPYRIDINES, PROCESS FOR THEIR PREPARATION, THEIR USE AS MEDICINES AND COMPOSITIONS CONTAINING THEM | ROUSSEL-UCLAF (FR) | 1992-09-09 | — | — | EP | disclosed |
| EP-0288394-A2 | 1,2,5,6-Tetrahydropyridines, process for their preparation, their use as medicines and compositions containing them | ROUSSEL-UCLAF (FR) | 1988-10-26 | — | — | EP | disclosed |