Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.38 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | ELANE | P08246 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL14640355 | 1.00 | ALDH1A1 (0.41) | ALDH1A1TAAR1TP53TSHRLMNA | |
| SCHEMBL28466587 | 0.80 | GABRA1 (0.47) | TAAR1TP53TSHRELANEL3MBTL1 | |
| SCHEMBL7933543 | 0.78 | TSHR (0.42) | ALDH1A1TAAR1TP53TSHRCYP3A4 | |
| SCHEMBL139640 | 0.77 | GABRA1 (0.52) | ALDH1A1TAAR1LMNAIDO1CYP3A4 | |
| SCHEMBL5710876 | 0.77 | TSHR (0.41) | TAAR1TP53TSHRLMNACYP3A4 | |
| SCHEMBL16463838 | 0.77 | SLC6A2 (0.46) | ALDH1A1TAAR1TP53TSHRLMNA | |
| SCHEMBL453540 | 0.77 | TSHR (0.41) | TAAR1TP53TSHRLMNACYP3A4 | |
| SCHEMBL14208189 | 0.77 | SLC6A2 (0.46) | ALDH1A1TAAR1TP53TSHRLMNA | |
| SCHEMBL3272345 | 0.77 | TSHR (0.45) | TAAR1TP53TSHRIDO1CYP2D6 | |
| SCHEMBL29440901 | 0.77 | TSHR (0.41) | TAAR1TP53TSHRLMNACYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1499603-A1 | ANTIVIRAL LACTONE-UREAS | Bayer Aktiengesellschaft (DE) | 2005-01-26 | — | — | EP | disclosed |
| WO-2003089421-A1 | ANTIVIRAL LACTONE-UREAS | BAYER HEALTHCARE AG (DE) | 2003-10-30 | — | — | WO | disclosed |