Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 4/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.37 |
| ▸ | NQO1 | P15559 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | CASP7 | P55210 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 2/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.33 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL31518688 | 0.82 | CYP2A6 (0.50) | CYP2A6MAPTCYP1A2ALDH1A1HIF1A | |
| SCHEMBL15757917 | 0.82 | CYP2A6 (0.50) | CYP2A6MAPTCYP1A2ALDH1A1HIF1A | |
| SCHEMBL4369821 | 0.81 | CYP2A6 (0.41) | CYP2A6MAPTCYP1A2ALDH1A1HIF1A | |
| SCHEMBL7918983 | 0.79 | CYP2A6 (0.48) | CYP2A6MAPTCYP1A2ALDH1A1HIF1A | |
| SCHEMBL2816321 | 0.79 | CYP2A6 (0.58) | CYP2A6MAPTCYP1A2ALDH1A1HIF1A | |
| SCHEMBL29699776 | 0.79 | CYP2A6 (0.58) | CYP2A6MAPTCYP1A2ALDH1A1HIF1A | |
| SCHEMBL3242358 | 0.77 | MAOA (0.50) | CYP2A6MAPTCYP1A2ALDH1A1HIF1A | |
| SCHEMBL30843834 | 0.77 | MAOA (0.50) | CYP2A6MAPTCYP1A2ALDH1A1HIF1A | |
| SCHEMBL3216540 | 0.75 | CYP2A6 (0.44) | CYP2A6MAPTCYP1A2ALDH1A1HIF1A | |
| SCHEMBL9550562 | 0.75 | CYP2A6 (0.44) | CYP2A6MAPTCYP1A2ALDH1A1HIF1A |
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 |
|---|---|---|---|---|---|---|---|
| JP-4049274-A | — | — | None | — | — | JP | disclosed |
| JP-H0449274-A | NOVEL TETRASELENOTETRACENE AND COMPLEX CONTAINING THE SAME | DAISO CO LTD | 1992-02-18 | — | — | JP | disclosed |