Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | MAPT | P10636 | 5/20 | 0.44 |
| ▸ | GLA | P06280 | 2/20 | 0.44 |
| ▸ | CTDSP1 | Q9GZU7 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | RECQL | P46063 | 2/20 | 0.41 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | TDO2 | P48775 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL8566420 | 1.00 | BRD4 (0.55) | BRD4ALDH1A1MAPTGLACTDSP1 | |
| SCHEMBL8566415 | 1.00 | BRD4 (0.55) | BRD4ALDH1A1MAPTGLACTDSP1 | |
| SCHEMBL3358621 | 0.82 | BRD4 (0.43) | BRD4ALDH1A1MAPTOPRM1MEN1 | |
| SCHEMBL17432672 | 0.76 | HPGD (0.51) | BRD4MAPTKDM4EIDO1POLB | |
| SCHEMBL30726842 | 0.76 | BRD4 (0.49) | BRD4ALDH1A1MAPTGLACTDSP1 | |
| SCHEMBL13330980 | 0.75 | BRD4 (0.39) | BRD4ALDH1A1MAPTGLAOPRM1 | |
| SCHEMBL10506242 | 0.74 | ALDH1A1 (0.45) | BRD4ALDH1A1MAPTGLACTDSP1 | |
| SCHEMBL8631966 | 0.74 | MAPT (0.56) | BRD4ALDH1A1MAPTGLACTDSP1 | |
| SCHEMBL13330978 | 0.73 | BRD4 (0.37) | BRD4MAPTOPRM1POLBLMNA | |
| SCHEMBL13330977 | 0.73 | BRD4 (0.37) | BRD4ALDH1A1OPRM1MEN1KMT2A |
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-5719141-A | HYPOTENSIVE AGENTS | NOVARTIS CORPORATION (US) | 1998-02-17 | — | — | US | disclosed |
| EP-0702004-A2 | 2,9-diamino- and 2-amino-8-carbamoyl-4-hydroxy-alkanoic acid amid derivatives | CIBA-GEIGY AG (CH) | 1996-03-20 | — | — | EP | disclosed |