Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.43 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.43 |
| ▸ | PYCR1 | P32322 | 2/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.32 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.32 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.32 |
| ▸ | ALB | P02768 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.32 |
| ▸ | RARB | P10826 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3074890 | 0.83 | GABRA1 (0.43) | GABRA1GABRB2S1PR1ALDH1A1MEN1 | |
| SCHEMBL17748246 | 0.77 | GABRA1 (0.47) | GABRA1GABRB2ALDH1A1MEN1POLB | |
| SCHEMBL11652715 | 0.75 | GABRA1 (0.42) | GABRA1GABRB2PYCR1ALDH1A1MEN1 | |
| SCHEMBL30151579 | 0.75 | GABRA1 (0.46) | GABRA1GABRB2MEN1POLBMAPT | |
| SCHEMBL19491783 | 0.75 | GABRA1 (0.46) | GABRA1GABRB2MEN1POLBMAPT | |
| SCHEMBL20875725 | 0.74 | GABRA1 (0.44) | GABRA1GABRB2S1PR1MEN1POLB | |
| SCHEMBL7562470 | 0.73 | GABRA1 (0.50) | GABRA1GABRB2ALDH1A1MEN1POLB | |
| SCHEMBL16245769 | 0.71 | TSHR (0.44) | GABRA1GABRB2S1PR1MEN1POLB | |
| SCHEMBL29671369 | 0.71 | TSHR (0.44) | GABRA1GABRB2S1PR1MEN1POLB | |
| SCHEMBL16245770 | 0.71 | GABRA1 (0.46) | GABRA1GABRB2ALDH1A1MEN1POLB |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3692127-B1 | PRO-FRAGRANCES AND METHOD OF PREPARATION THEREOF | HENKEL AG & CO KGAA (DE) | 2021-08-11 | — | — | EP | claimed |
| EP-3692127-A1 | PRO-FRAGRANCES AND METHOD OF PREPARATION THEREOF | Henkel AG & Co. KGaA (DE) | 2020-08-12 | — | — | EP | disclosed |
| EP-3692131-A1 | COMPOSITION COMPRISING PRECURSORS FOR VOLATILES | Henkel AG & Co. KGaA (DE) | 2020-08-12 | — | — | EP | disclosed |
| WO-2019068511-A1 | PRO-FRAGRANCES AND METHOD OF PREPARATION THEREOF | HENKEL AG & CO. KGAA (DE) | 2019-04-11 | — | — | WO | disclosed |
| WO-2019068510-A1 | COMPOSITION COMPRISING PRECURSORS FOR VOLATILES | HENKEL AG & CO. KGAA (DE) | 2019-04-11 | — | — | WO | disclosed |