Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | ACP3 | P15309 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28200881 | 0.84 | MAPT (0.45) | MEN1KMT2ASLC6A4SLC6A2SLC6A3 | |
| SCHEMBL9666274 | 0.83 | SLC6A2 (0.40) | MEN1KMT2ASLC6A4SLC6A2SLC6A3 | |
| SCHEMBL9463326 | 0.83 | TSHR (0.43) | SLC6A4SLC6A2SLC6A3AOC3TSHR | |
| SCHEMBL31527960 | 0.83 | TSHR (0.43) | SLC6A4SLC6A2SLC6A3AOC3TSHR | |
| Hydrochloric Acid SCHEMBL28200249 | 0.83 | MAPT (0.47) | MEN1KMT2APOLBSLC6A4SLC6A2 | |
| SCHEMBL9663611 | 0.82 | ALDH1A1 (0.46) | KMT2ASLC6A4SLC6A2SLC6A3MAPK1 | |
| Setazindol SCHEMBL160950 | 0.82 | SLC6A4 (0.48) | SLC6A4SLC6A2SLC6A3CYP1A2CYP2D6 | |
| SCHEMBL1682166 | 0.76 | MEN1 (0.48) | MEN1KMT2ATSHRMAPK1GAA | |
| SCHEMBL14181097 | 0.74 | TSHR (0.47) | AOC3TSHRMAPK1GAAALDH1A1 | |
| SCHEMBL5671557 | 0.73 | TSHR (0.46) | SLC6A4SLC6A2AOC3TSHRMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5162371-A | Benzylamine Devivatives | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) | 1992-11-10 | — | — | US | disclosed |
| US-5028630-A | Benzylamines | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) | 1991-07-02 | — | — | US | disclosed |