Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.46 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.44 |
| ▸ | IDO1 | P14902 | 2/20 | 0.44 |
| ▸ | AGXT | P21549 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.42 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL13849941 | 0.83 | TAAR1 (0.58) | TAAR1CHRM2ADRB2IDO1AGXT | |
| SCHEMBL13849891 | 0.83 | TAAR1 (0.58) | TAAR1CHRM2ADRB2IDO1AGXT | |
| SCHEMBL14402407 | 0.83 | TAAR1 (0.58) | TAAR1CHRM2ADRB2IDO1AGXT | |
| SCHEMBL5794914 | 0.81 | TAAR1 (0.60) | TAAR1KDM4ECHRM2ADRB2IDO1 | |
| SCHEMBL7510495 | 0.80 | TAAR1 (0.62) | TAAR1CHRM2ADRB2IDO1AGXT | |
| SCHEMBL3179539 | 0.80 | TAAR1 (0.62) | TAAR1CHRM2ADRB2IDO1AGXT | |
| SCHEMBL7510484 | 0.80 | TAAR1 (0.62) | TAAR1CHRM2ADRB2IDO1AGXT | |
| SCHEMBL27695134 | 0.78 | TAAR1 (0.60) | TAAR1ALDH1A1CHRM2ADRB2IDO1 | |
| SCHEMBL27695145 | 0.78 | TAAR1 (0.60) | TAAR1ALDH1A1CHRM2ADRB2IDO1 | |
| SCHEMBL20668209 | 0.78 | HTR1A (0.47) | TAAR1CHRM2CHRM1CHRM3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008049651-A1 | PERFORMANCE-ENHANCED COSMETIC COMPOSITIONS WITH PURINE AND/OR PURINE DERIVATIVES | HENKEL AG & CO. KGAA (DE) | 2008-05-02 | — | — | WO | disclosed |