Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 4/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.41 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.41 |
| ▸ | DHFR | P00374 | 1/20 | 0.41 |
| ▸ | MPO | P05164 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.41 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| O-Xylene SCHEMBL30799221 | 0.86 | ACHE (0.62) | ACHETSHRLMNACYP1A2CYP3A4 | |
| Benzene SCHEMBL22829865 | 0.83 | TRPA1 (0.58) | ACHETSHRTRPA1ATMLMNA | |
| O-Xylene SCHEMBL3835918 | 0.80 | TSHR (0.71) | ACHETSHRTRPA1ATMLMNA | |
| SCHEMBL40704 | 0.80 | — | — | |
| SCHEMBL5494561 | 0.80 | TRPA1 (0.61) | ACHETSHRTRPA1ATMCYP1A2 | |
| Toluene SCHEMBL337110 | 0.78 | ACHE (0.65) | ACHETSHRTRPA1ATMLMNA | |
| Biphenyl SCHEMBL4006535 | 0.78 | ALDH1A1 (0.53) | ACHETSHRTRPA1ATMLMNA | |
| Fluorobenzene SCHEMBL9809616 | 0.77 | TSHR (0.45) | ACHETSHRLMNACYP3A4KDM4E | |
| Hydrochloric Acid SCHEMBL22194330 | 0.76 | TRPA1 (0.58) | ACHETSHRTRPA1ATMLMNA | |
| Bromide SCHEMBL21173634 | 0.76 | TRPA1 (0.58) | ACHETSHRTRPA1ATMLMNA |
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-20060223221-A1 | Method of manufacturing organic electroluminescent device and method of manufacturing device | SEIKO EPSON CORPORATION (JP) | 2006-10-05 | — | — | US | disclosed |