Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.55 |
| ▸ | PAM | P19021 | 1/20 | 0.37 |
| ▸ | ACLY | P53396 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3422146 | 0.81 | ALDH1A1 (0.30) | ALDH1A1CYP2D6ALOX15 | |
| SCHEMBL6202237 | 0.75 | MAPT (0.43) | ALDH1A1CYP2D6ALOX15 | |
| SCHEMBL25304685 | 0.74 | CYP2D6 (0.55) | ALDH1A1CYP2D6ALOX15PAMACLY | |
| SCHEMBL98443 | 0.74 | CYP2D6 (0.55) | ALDH1A1CYP2D6ALOX15PAMACLY | |
| SCHEMBL10707321 | 0.74 | — | — | |
| SCHEMBL8000395 | 0.74 | ALDH1A1 (0.55) | ALDH1A1CYP2D6ALOX15PAM | |
| SCHEMBL3134391 | 0.73 | CYP2D6 (1.00) | ALDH1A1CYP2D6ALOX15PAM | |
| SCHEMBL190067 | 0.73 | CYP2D6 (1.00) | ALDH1A1CYP2D6ALOX15PAM | |
| SCHEMBL28168136 | 0.73 | CYP2D6 (1.00) | ALDH1A1CYP2D6ALOX15PAM | |
| SCHEMBL213024 | 0.73 | CYP2D6 (1.00) | ALDH1A1CYP2D6ALOX15PAM |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1501877-A1 | FLUORINATED POLYMERS | Honeywell International Inc. (US) | 2005-02-02 | — | — | EP | disclosed |
| WO-2003095505-A1 | FLUORINATED POLYMERS | HONEYWELL INTERNATIONAL INC. (US) | 2003-11-20 | — | — | WO | disclosed |
| US-4874781-A | INSECTICIDES | NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) | 1989-10-17 | — | — | US | disclosed |