Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | ATM | Q13315 | 1/20 | 0.54 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.54 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.49 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.49 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.47 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.42 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9117450 | 0.86 | SIGMAR1 (0.61) | KDM4ECYP3A4MAPTATMTAAR1 | |
| SCHEMBL11780035 | 0.85 | TAAR1 (0.53) | KDM4ECYP3A4MAPTATMTAAR1 | |
| Hydrochloric Acid SCHEMBL11780924 | 0.83 | TAAR1 (0.52) | KDM4ECYP3A4MAPTATMTAAR1 | |
| SCHEMBL3130671 | 0.83 | SLC6A2 (0.67) | KDM4ECYP3A4MAPTATMTAAR1 | |
| SCHEMBL8016874 | 0.82 | SLC6A4 (0.57) | KDM4ECYP3A4MAPTTAAR1SLC6A2 | |
| SCHEMBL31265560 | 0.82 | SLC6A4 (0.57) | KDM4ECYP3A4MAPTTAAR1SLC6A2 | |
| SCHEMBL55137 | 0.82 | HTR1A (0.58) | TAAR1HTR1ADRD2SMN1; SMN2HTR2A | |
| Dimethylamine SCHEMBL7752533 | 0.79 | TAAR1 (0.64) | KDM4ECYP3A4MAPTATMTAAR1 | |
| SCHEMBL9512782 | 0.78 | SLC6A4 (0.49) | KDM4ECYP3A4MAPTTAAR1SLC6A2 | |
| SCHEMBL2996327 | 0.78 | HTR2A (0.68) | ATMTAAR1HTR1ADRD2SMN1; SMN2 |
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-3988454-A | ANTIARRHYTHMICS | MERCK & CO., INC. (US) | 1976-10-26 | — | — | US | disclosed |