Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | TYMP | P19971 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL10601318 | 0.89 | TYR (0.39) | TAAR1CHRM2P2RX7 | |
| SCHEMBL6546915 | 0.88 | TAAR1 (0.42) | TAAR1ESR1ARCHRM2PTGS1 | |
| SCHEMBL2994883 | 0.82 | L3MBTL1 (0.42) | TAAR1ESR1TSHRCNR2GPR55 | |
| SCHEMBL6547484 | 0.82 | TSHR (0.50) | TAAR1ESR1ARCHRM2TSHR | |
| SCHEMBL2090458 | 0.82 | TAAR1 (0.56) | TAAR1ARCHRM2PTGS1PTGS2 | |
| SCHEMBL29477327 | 0.82 | TAAR1 (0.56) | TAAR1ARCHRM2PTGS1PTGS2 | |
| SCHEMBL24631776 | 0.81 | TAAR1 (0.46) | TAAR1ESR1ARALDH1A1HPGD | |
| SCHEMBL9621605 | 0.80 | SMN1; SMN2 (0.39) | TSHRALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL11200954 | 0.79 | TAAR1 (0.54) | TAAR1ARCHRM2PTGS1PTGS2 | |
| SCHEMBL29772212 | 0.79 | TAAR1 (0.54) | TAAR1ARCHRM2PTGS1PTGS2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0316014-B1 | METHOD FOR PRODUCING ARYLETHYLENES | NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) | 1992-04-01 | — | — | EP | disclosed |
| US-4855519-A | Method for producing arylethylene | NIPPON PETROCHEMICALS COMPANY (JP) | 1989-08-08 | — | — | US | disclosed |
| EP-0316014-A2 | Method for producing arylethylenes | NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) | 1989-05-17 | — | — | EP | disclosed |