Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 6/20 | 0.50 |
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.50 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.38 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | HSD11B2 | P80365 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.35 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8184370 | 0.98 | SLC6A4 (0.53) | SLC6A4SLC6A3SLC6A2MAP4K4OPRM1 | |
| SCHEMBL18742609 | 0.96 | SLC6A4 (0.46) | SLC6A4SLC6A3SLC6A2MAP4K4OPRM1 | |
| SCHEMBL838201 | 0.93 | SLC6A4 (0.45) | SLC6A4SLC6A3SLC6A2OPRM1HSD11B1 | |
| SCHEMBL29457607 | 0.93 | SLC6A4 (0.45) | SLC6A4SLC6A3SLC6A2OPRM1HSD11B1 | |
| SCHEMBL15861905 | 0.86 | SLC6A4 (0.40) | SLC6A4SLC6A3MAP4K4OPRM1PDE7A | |
| SCHEMBL28678474 | 0.85 | SLC6A4 (0.40) | SLC6A4SLC6A3SLC6A2OPRM1ALDH1A1 | |
| SCHEMBL6962020 | 0.85 | HTR2C (0.40) | SLC6A4SLC6A3SLC6A2OPRM1ALDH1A1 | |
| SCHEMBL11093050 | 0.83 | SLC6A3 (0.39) | SLC6A4SLC6A3SLC6A2OPRM1PDE7A | |
| SCHEMBL1072002 | 0.83 | SLC6A4 (0.36) | SLC6A4SLC6A3MAP4K4OPRM1HSD11B1 | |
| SCHEMBL1021621 | 0.81 | PSEN1 (0.37) | SLC6A4SLC6A3MAP4K4OPRM1HSD11B1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4237158-A | FOR PLANT DISEASES; PLANT GROWTH REGULATORS | ROHM AND HAAS COMPANY (US) | 1980-12-02 | — | — | US | disclosed |
| US-4118461-A | FUNGICIDES | ROHM AND HAAS COMPANY (US) | 1978-10-03 | — | — | US | disclosed |
| US-4115578-A | FUNGICIDES | ROHM AND HAAS COMPANY (US) | 1978-09-19 | — | — | US | disclosed |
| US-4105762-A | Metal salt complexes of 1-substituted aralkyl imidazoles, and methods and compositions for controlling phytopathogenic fungi using them | ROHM AND HAAS COMPANY (US) | 1978-08-08 | — | — | US | disclosed |