Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL3833231 | 0.67 | AHR (0.31) | — | |
| SCHEMBL2593530 | 0.63 | CYP3A4 (0.56) | ALDH1A1CYP3A4 | |
| SCHEMBL9742121 | 0.63 | ALDH1A1 (0.34) | ALDH1A1CYP3A4 | |
| SCHEMBL5074455 | 0.62 | GAA (0.53) | ALDH1A1CYP3A4 | |
| SCHEMBL321694 | 0.61 | GPR84 (0.41) | — | |
| SCHEMBL6928459 | 0.61 | CYP3A4 (0.36) | CYP3A4 | |
| SCHEMBL6011023 | 0.59 | ALDH1A1 (0.42) | ALDH1A1 | |
| SCHEMBL152187 | 0.59 | CSNK2A1 (0.44) | — | |
| SCHEMBL207906 | 0.59 | HTR1A (0.31) | — | |
| SCHEMBL7289940 | 0.59 | CYP3A4 (0.59) | ALDH1A1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-5175157-A | Cardiovascular disorders | BOEHRINGER INGELHEIM GMBH (DE) | 1992-12-29 | — | — | US | disclosed |