Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 8/20 | 0.51 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL24117533 | 0.79 | CYP19A1 (0.59) | CYP19A1EPHX1MAPTALDH1A1KDM4E | |
| SCHEMBL9834168 | 0.71 | LOXL2 (0.49) | EPHX1ALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL17801467 | 0.71 | LMNA (0.46) | ALDH1A1MEN1KMT2A | |
| SCHEMBL4681053 | 0.69 | LOXL2 (0.46) | CYP19A1MAPTALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL10528462 | 0.69 | EPHX2 (0.71) | CYP19A1EPHX1MAPTPKMALDH1A1 | |
| SCHEMBL10352908 | 0.68 | MAPT (0.64) | EPHX1MAPTPKMALDH1A1 | |
| Hydrochloric Acid SCHEMBL10527779 | 0.68 | CYP19A1 (0.55) | CYP19A1EPHX1MAPTALDH1A1KDM4E | |
| SCHEMBL9336424 | 0.68 | CYP19A1 (1.00) | CYP19A1 | |
| SCHEMBL8910496 | 0.67 | CYP19A1 (0.55) | CYP19A1EPHX1MAPT | |
| SCHEMBL10305183 | 0.67 | CYP19A1 (0.44) | CYP19A1EPHX1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0532693-A1 | 1,4-DIAMINO-2,3-DIHYDROXYBUTANES | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1993-03-24 | — | — | EP | disclosed |