Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | PGR | P06401 | 2/20 | 0.41 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.41 |
| ▸ | CCR5 | P51681 | 10/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | TACR2 | P21452 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | UTS2R | Q9UKP6 | 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 | |
|---|---|---|---|---|
| Fumaric Acid SCHEMBL1936521 | 0.94 | ACHE (0.41) | ACHEPGRHTR4CCR5TP53 | |
| SCHEMBL1937237 | 0.91 | HTR4 (0.43) | ACHEPGRHTR4CCR5TACR2 | |
| SCHEMBL2393607 | 0.89 | PGR (0.43) | ACHEPGRCCR5TP53OPRM1 | |
| SCHEMBL1937232 | 0.85 | SLC6A4 (0.44) | ACHEHTR4TP53 | |
| Fumaric Acid SCHEMBL1936426 | 0.85 | HTR4 (0.39) | ACHEPGRHTR4CCR5TACR2 | |
| SCHEMBL2541058 | 0.84 | CCR5 (0.41) | ACHEPGRHTR4CCR5OPRM1 | |
| SCHEMBL1936605 | 0.84 | HTR4 (0.44) | HTR4TACR2OPRM1OPRK1UTS2R | |
| Fumaric Acid SCHEMBL1936089 | 0.83 | CCR5 (0.39) | ACHEPGRCCR5TP53OPRM1 | |
| SCHEMBL1937163 | 0.81 | HTR4 (0.41) | ACHEPGRHTR4OPRM1 | |
| Fumaric Acid SCHEMBL1937241 | 0.80 | SLC6A4 (0.43) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010023196-A2 | NOVEL PIPERIDINE-PROPIONAMIDE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS | NEUROSEARCH A/S (DK) | 2010-03-04 | — | — | WO | disclosed |