Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 3/20 | 0.57 |
| ▸ | GRM5 | P41594 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | PPIA | P62937 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | MET | P08581 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11740146 | 1.00 | BRD4 (0.57) | BRD4GRM5L3MBTL1TDP1TSHR | |
| SCHEMBL11740161 | 0.84 | RAB9A (0.53) | GRM5SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL11741509 | 0.84 | RAB9A (0.53) | GRM5SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL11742262 | 0.83 | EPHX2 (0.54) | GRM5SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL11742256 | 0.83 | EPHX2 (0.54) | GRM5SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL11740171 | 0.80 | GRM5 (0.54) | GRM5SMN1; SMN2ALDH1A1MAPTHTT | |
| SCHEMBL11740168 | 0.80 | GRM5 (0.54) | GRM5SMN1; SMN2ALDH1A1MAPTHTT | |
| SCHEMBL11744210 | 0.80 | GRM5 (0.59) | GRM5 | |
| SCHEMBL11740359 | 0.80 | GRM5 (0.59) | GRM5 | |
| SCHEMBL11738695 | 0.77 | GRM5 (0.67) | GRM5SMN1; SMN2ALDH1A1CYP1A2CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-4046909-A | Pyrrolidylidene, piperidylidene and hexahydroazepinylidene ureas as CNS depressants | MCNEIL LABORATORIES, INCORPORATED (US) | 1977-09-06 | — | — | US | disclosed |