Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | AGXT | P21549 | 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 | |
|---|---|---|---|---|
| SCHEMBL842341 | 0.86 | TDP1 (0.33) | CYP1A2TAAR1ALDH1A1 | |
| SCHEMBL8380624 | 0.67 | CYP1A2 (0.48) | CYP1A2CYP2A6TAAR1KMT2AMEN1 | |
| SCHEMBL24602755 | 0.66 | CYP1A2 (0.52) | CYP1A2CYP2A6TAAR1KMT2AMEN1 | |
| SCHEMBL8380481 | 0.66 | CYP1A2 (0.43) | CYP1A2CYP2A6TAAR1KMT2AMEN1 | |
| SCHEMBL9231420 | 0.65 | CYP1A2 (0.46) | CYP1A2CYP2A6TAAR1KMT2AMEN1 | |
| SCHEMBL387841 | 0.64 | CYP1A2 (0.45) | CYP1A2CYP2A6TAAR1KMT2AAGXT | |
| SCHEMBL446130 | 0.63 | CYP1A2 (0.48) | CYP1A2CYP2A6TAAR1KMT2AMEN1 | |
| SCHEMBL17753735 | 0.63 | CYP1A2 (0.43) | CYP1A2CYP2A6TAAR1KMT2AMEN1 | |
| SCHEMBL11648990 | 0.62 | TAAR1 (0.46) | CYP1A2CYP2A6TAAR1KMT2AAGXT | |
| SCHEMBL11653627 | 0.61 | CYP1A2 (0.38) | CYP1A2CYP2A6TAAR1KMT2AMEN1 |
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-8143363-B2 | Polymerizable composition | HENKEL AG & CO. KGAA (DE) | 2012-03-27 | — | — | US | disclosed |
| US-20110105680-A1 | Polymerizable Composition | HENKEL AG & CO. KGAA (DE) | 2011-05-05 | — | — | US | disclosed |