Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.61 |
| ▸ | LMNA | P02545 | 2/20 | 0.61 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.61 |
| ▸ | ACHE | P22303 | 1/20 | 0.61 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.54 |
| ▸ | HTR2A | P28223 | 3/20 | 0.50 |
| ▸ | HRH1 | P35367 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | TNNI3 | P19429 | 1/20 | 0.46 |
| ▸ | TNNT2 | P45379 | 1/20 | 0.46 |
| ▸ | TNNC1 | P63316 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Toluene SCHEMBL9516032 | 0.85 | TSHR (0.50) | TSHRLMNAALOX12ACHETAAR1 | |
| Toluene SCHEMBL16465853 | 0.84 | HTR2A (0.48) | TSHRLMNAALOX12ACHETAAR1 | |
| Toluene SCHEMBL3958941 | 0.82 | ACHE (0.79) | TSHRLMNAALOX12ACHEHTR2A | |
| Toluene SCHEMBL27670735 | 0.79 | ACHE (0.73) | TSHRLMNAALOX12ACHEHTR2A | |
| Toluene SCHEMBL28245344 | 0.79 | ACHE (0.73) | TSHRLMNAALOX12ACHEHTR2A | |
| Toluene SCHEMBL28070600 | 0.79 | ACHE (0.73) | TSHRLMNAALOX12ACHEMEN1 | |
| Toluene SCHEMBL18037047 | 0.79 | ACHE (0.73) | TSHRLMNAALOX12ACHEHTR2A | |
| Toluene SCHEMBL27984465 | 0.79 | ACHE (0.73) | TSHRLMNAALOX12ACHEMEN1 | |
| Toluene SCHEMBL28783234 | 0.79 | ACHE (0.73) | TSHRLMNAALOX12ACHEHTR2A | |
| Toluene SCHEMBL27499167 | 0.79 | ACHE (0.73) | TSHRLMNAALOX12ACHEHTR2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023210569-A1 | NOVEL COMPOUND, CONJUGATED POLYMER AND METHOD FOR PRODUCING SAME, FILM FORMATION COMPOSITION, ORGANIC THIN FILM, AND ORGANIC SEMICONDUCTOR ELEMENT | 東ソー株式会社 | 2023-11-02 | — | — | WO | disclosed |
| US-5556997-A | Enhanced synthesis of racemic metallocenes | ALBEMARLE CORPORATION (US) | 1996-09-17 | — | — | US | disclosed |