Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | KIF11 | P52732 | 4/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL21066247 | 0.94 | ALDH1A1 (0.46) | ALDH1A1TSHRCYP1A2 | |
| SCHEMBL8383958 | 0.92 | ALDH1A1 (0.44) | ALDH1A1TSHRCYP1A2 | |
| SCHEMBL476546 | 0.88 | ALDH1A1 (0.48) | ALDH1A1TSHRCYP1A2 | |
| SCHEMBL476554 | 0.80 | ALDH1A1 (0.52) | ALDH1A1TSHRCYP1A2 | |
| SCHEMBL16626146 | 0.80 | ALDH1A1 (0.58) | ALDH1A1CA1CA2TSHRCYP1A2 | |
| SCHEMBL21920722 | 0.78 | KIF11 (0.54) | ALDH1A1CA1CA2KIF11CYP1A2 | |
| SCHEMBL5513731 | 0.78 | KIF11 (0.54) | ALDH1A1CA1CA2KIF11CYP1A2 | |
| SCHEMBL673282 | 0.75 | LMNA (0.43) | CA1CA2 | |
| SCHEMBL1421311 | 0.75 | KIF11 (0.56) | ALDH1A1KIF11TSHRCYP1A2 | |
| SCHEMBL1005055 | 0.75 | CYP1A2 (0.33) | CYP1A2 |
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-6388146-B1 | AROMATIC UNSATURATED NOMONER | SHARP KABUSHIKI KAISHA (JP) | 2002-05-14 | — | — | US | disclosed |