Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 4/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 3/20 | 0.39 |
| ▸ | RELA | Q04206 | 2/20 | 0.38 |
| ▸ | MAOB | P27338 | 3/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.37 |
| ▸ | MAOA | P21397 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL78055 | 0.86 | ALDH1A1 (0.48) | ALDH1A1TSHRCYP1A1CYP1A2CYP1B1 | |
| SCHEMBL27453293 | 0.82 | ALDH1A1 (0.40) | ALDH1A1TSHRTRPA1TP53TDP1 | |
| SCHEMBL11547658 | 0.80 | RELA (0.56) | CYP1A1CYP1A2CYP1B1NFE2L2TRPA1 | |
| SCHEMBL11547663 | 0.80 | RELA (0.56) | CYP1A1CYP1A2CYP1B1NFE2L2TRPA1 | |
| SCHEMBL28195017 | 0.78 | MAOB (0.62) | ALDH1A1TSHRNFE2L2TRPA1RELA | |
| SCHEMBL9246477 | 0.76 | MAOB (0.61) | ALDH1A1TSHRNFE2L2TRPA1MAOB | |
| Styrene SCHEMBL10784465 | 0.76 | ALDH1A1 (0.67) | ALDH1A1TSHRCYP1A2NFE2L2TRPA1 | |
| Styrene SCHEMBL10534525 | 0.76 | ALDH1A1 (0.67) | ALDH1A1TSHRCYP1A2NFE2L2TRPA1 | |
| Styrene SCHEMBL10493198 | 0.76 | ALDH1A1 (0.67) | ALDH1A1TSHRCYP1A2NFE2L2TRPA1 | |
| SCHEMBL11289680 | 0.75 | ALOX5 (0.42) | ALDH1A1CYP1A1CYP1A2CYP1B1NFE2L2 |
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-4480057-A | WITH CRYSTALLINE OLEFIN POLYMER, OR HYDROGENATED STYRENE-CONJUGATED DIENE | MITSUBISHI PETROCHEMICAL CO., LTD. (JP) | 1984-10-30 | — | — | US | disclosed |