Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | ALOX5AP | P20292 | 2/20 | 0.30 |
| ▸ | FEN1 | P39748 | 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 | |
|---|---|---|---|---|
| SCHEMBL6831272 | 0.84 | CA12 (0.33) | ALDH1A1 | |
| SCHEMBL11349011 | 0.82 | RELA (0.37) | ALDH1A1 | |
| SCHEMBL14336087 | 0.81 | RELA (0.42) | — | |
| SCHEMBL10019048 | 0.81 | NLRP3 (0.30) | ALOX5APFEN1 | |
| SCHEMBL14515808 | 0.78 | POLB (0.35) | ALDH1A1 | |
| SCHEMBL5547021 | 0.77 | MEN1 (0.36) | ALDH1A1 | |
| SCHEMBL14557145 | 0.77 | RELA (0.36) | TSHR | |
| SCHEMBL14549938 | 0.75 | — | — | |
| SCHEMBL14515822 | 0.75 | — | — | |
| SCHEMBL10510598 | 0.74 | TSHR (0.36) | TSHRALOX5APFEN1 |
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-6747027-B1 | SELECTIVELY INHIBITS IN VITRO ACTIVITY OF HUMAN MATRIX METALLOPROTEASE-13 OVER IN VITRO ACTIVITY OF HUMAN MATRIX METALLOPROTEASE-1 | PHARMACIA CORPORATION | 2004-06-08 | — | — | US | disclosed |