Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | SREBF2 | Q12772 | 1/20 | 0.50 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.47 |
| ▸ | HRH1 | P35367 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.46 |
| ▸ | CTSK | P43235 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Dipyridyl SCHEMBL9115752 | 0.89 | KDM4E (0.56) | CYP1A2CYP2C19CYP2D6CYP19A1CYP2C9 | |
| SCHEMBL29583126 | 0.85 | — | — | |
| SCHEMBL10527 | 0.85 | — | — | |
| SCHEMBL123540 | 0.83 | HRH1 (0.55) | CYP1A2CYP2C19CYP2D6CYP19A1CYP2C9 | |
| SCHEMBL30101413 | 0.83 | HRH1 (0.59) | CYP1A2CYP2C19CYP2D6HRH3HRH1 | |
| Hydrochloric Acid SCHEMBL28050227 | 0.83 | ALDH1A1 (0.62) | CYP1A2CYP2C19CYP2D6HRH3HRH1 | |
| Bromide SCHEMBL14801933 | 0.83 | HRH1 (0.59) | CYP1A2CYP2C19CYP2D6HRH3HRH1 | |
| SCHEMBL11564094 | 0.83 | HRH1 (0.59) | CYP1A2CYP2C19CYP2D6HRH3HRH1 | |
| Iodide SCHEMBL22551708 | 0.83 | HRH1 (0.59) | CYP1A2CYP2C19CYP2D6HRH3HRH1 | |
| Ammonia Solution, Strong SCHEMBL1509120 | 0.83 | HRH1 (0.59) | CYP1A2CYP2C19CYP2D6HRH3HRH1 |
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-4011392-A | COATINGS | THE SHERWIN-WILLIAMS COMPANY (US) | 1977-03-08 | — | — | US | disclosed |