Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.45 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.43 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.43 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA4 | P22748 | 1/20 | 0.43 |
| ▸ | CA6 | P23280 | 1/20 | 0.43 |
| ▸ | CA5A | P35218 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.43 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.43 |
| ▸ | BACE1 | P56817 | 3/20 | 0.43 |
| ▸ | GSK3B | P49841 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4964002 | 0.85 | APP (0.46) | CYP1A1ABCG2CA12CA4CA6 | |
| SCHEMBL5145553 | 0.84 | CYP1A2 (0.50) | CYP1A2CYP1A1CYP19A1ABCG2AKR1B10 | |
| SCHEMBL7263890 | 0.82 | APP (0.48) | CYP1A1ABCG2CA12CA7CA9 | |
| SCHEMBL6741792 | 0.81 | LMNA (0.37) | BACE1GSK3BLMNAPPARGPPARA | |
| Acrylic Acid Methyl Ester SCHEMBL7270941 | 0.74 | CA12 (0.43) | ABCG2AKR1B10AKR1B1CA12CA7 | |
| SCHEMBL7270957 | 0.73 | STAT3 (0.41) | ABCG2CA12CA7CA9CA14 | |
| SCHEMBL7263305 | 0.73 | CA12 (0.42) | ABCG2CA12CA7CA9CA14 | |
| SCHEMBL6387605 | 0.72 | APP (0.38) | CYP1A1ABCG2CA12CA7CA9 | |
| SCHEMBL3264447 | 0.72 | APP (0.47) | CYP1A1ABCG2AKR1B10AKR1B1CA12 | |
| Styrene SCHEMBL8521357 | 0.72 | STAT3 (0.38) | CYP1A2CYP1A1CYP19A1ABCG2PPARG |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6682869-B2 | IN POLYMER | SHIN-ETU CHEMICAL CO., LTD. (JP) | 2004-01-27 | — | — | US | disclosed |
| US-20010038971-A1 | Chemical amplification, positive resist compositions | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2001-11-08 | — | — | US | disclosed |