Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | METAP1 | P53582 | 4/20 | 0.36 |
| ▸ | NQO1 | P15559 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10427286 | 0.77 | METAP1 (0.38) | METAP1 | |
| SCHEMBL10427272 | 0.71 | CDC7 (0.41) | CA1CA9MEN1CYP3A4KMT2A | |
| SCHEMBL3135172 | 0.69 | TDP1 (0.53) | TDP1NQO1CA1CA9MEN1 | |
| SCHEMBL10426958 | 0.69 | TDP1 (0.53) | TDP1NQO1CA1CA9MEN1 | |
| SCHEMBL25797346 | 0.66 | MEN1 (0.42) | TDP1NQO1MEN1KMT2A | |
| SCHEMBL10535829 | 0.65 | METAP1 (0.46) | TDP1METAP1NQO1 | |
| SCHEMBL21395372 | 0.65 | HSD17B10 (0.37) | TDP1METAP1NQO1 | |
| SCHEMBL13600314 | 0.64 | TDP1 (0.45) | TDP1NQO1CA1CA9MEN1 | |
| SCHEMBL10427201 | 0.63 | METAP1 (0.71) | METAP1 | |
| SCHEMBL19416655 | 0.63 | METAP1 (0.71) | TDP1METAP1CA1CA9 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0127143-B1 | NOVEL ARYLOXYCYCLOALKANOLAMINOALKYLENE ARYL KETONES | MERRELL DOW PHARMACEUTICALS INC. (US) | 1990-03-21 | — | — | EP | disclosed |
| US-4868315-A | HYPOTENSIVE AGENTS | MERRELL DOW PHARMACEUTICALS INC. (US) | 1989-09-19 | — | — | US | disclosed |
| US-4745222-A | HYPOTENSIVE AGENTS | MERRELL DOW PHARMACEUTICALS INC. (US) | 1988-05-17 | — | — | US | disclosed |
| EP-0127143-A2 | Novel aryloxycycloalkanolaminoalkylene aryl ketones | MERRELL DOW PHARMACEUTICALS INC. (US) | 1984-12-05 | — | — | EP | disclosed |