Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 4/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CTSS | P25774 | 1/20 | 0.39 |
| ▸ | CTSK | P43235 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| M-Xylene SCHEMBL11709090 | 0.85 | ACHE (0.71) | ACHEALDH1A1MAPK1MAPTCYP1A2 | |
| M-Xylene SCHEMBL10785138 | 0.82 | ACHE (0.75) | ACHEALDH1A1MAPK1MAPTCYP1A2 | |
| Toluene SCHEMBL9712043 | 0.80 | TSHR (0.58) | ACHEALDH1A1CYP2C19HTTLMNA | |
| M-Xylene SCHEMBL28225217 | 0.79 | ACHE (0.71) | ACHEALDH1A1MAPK1MAPTCYP1A2 | |
| M-Xylene SCHEMBL28720164 | 0.79 | ACHE (0.80) | ACHEALDH1A1MAPK1MAPTCYP1A2 | |
| M-Xylene SCHEMBL28412698 | 0.79 | ACHE (0.92) | ACHEALDH1A1MAPK1MAPTCYP1A2 | |
| M-Xylene SCHEMBL27743860 | 0.79 | ACHE (0.92) | ACHEALDH1A1MAPK1MAPTCYP1A2 | |
| M-Xylene SCHEMBL27411614 | 0.79 | — | — | |
| M-Xylene SCHEMBL78260 | 0.79 | ACHE (0.92) | ACHEALDH1A1MAPK1MAPTCYP1A2 | |
| M-Xylene SCHEMBL1270011 | 0.79 | — | — |
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-4026831-A | ADHESIVES, PAINT RESINS, ELECTROSTATIC INHIBITORS, RUST INHIBITORS | MIYOSHI YUSHI KABUSHIKI KAISHA (JA) | 1977-05-31 | — | — | US | disclosed |