Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | ALDH1A2 | O94788 | 1/20 | 0.34 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.34 |
| ▸ | ALDH1B1 | P30837 | 1/20 | 0.34 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CCR5 | P51681 | 2/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 2/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.32 |
| ▸ | TACR2 | P21452 | 2/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3929292 | 0.93 | NPC1 (0.38) | THRBALDH1A1ALDH1A2ALDH2ALDH1B1 | |
| SCHEMBL3923923 | 0.86 | ALDH1A1 (0.39) | ALDH1A1ALDH1A2ALDH2ALDH1B1ALDH1A3 | |
| SCHEMBL16701741 | 0.72 | TYR (0.42) | ALDH1A1PTGS2CYP3A4MAPTSMN1; SMN2 | |
| SCHEMBL3930085 | 0.72 | MAPT (0.36) | ALDH1A1ALDH1A2ALDH2ALDH1B1ALDH1A3 | |
| SCHEMBL3920357 | 0.72 | TYR (0.34) | THRBALDH1A1ALDH1A2ALDH2ALDH1B1 | |
| SCHEMBL3922014 | 0.71 | TYR (0.37) | THRBALDH1A1ALDH1A2ALDH2ALDH1B1 | |
| SCHEMBL14389463 | 0.71 | MAPT (0.35) | ALDH1A1ALDH1A2ALDH2ALDH1B1ALDH1A3 | |
| SCHEMBL3918783 | 0.71 | TYR (0.37) | THRBALDH1A1ALDH1A2ALDH2ALDH1B1 | |
| SCHEMBL5679424 | 0.69 | TSHR (0.50) | THRBALDH1A1PTGS2CYP3A4CYP19A1 | |
| SCHEMBL11619551 | 0.67 | TYR (0.38) | ALDH1A1PTGS2CYP3A4MAPTALOX5 |
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-2027101-A1 | TRISUBSTITUTED FURAN DERIVATIVES AS FRAGRANCES AND AROMA SUBSTANCES | Symrise GmbH & Co. KG (DE) | 2009-02-25 | — | — | EP | disclosed |
| WO-2007131834-A1 | TRISUBSTITUTED FURAN DERIVATIVES AS FRAGRANCES AND AROMA SUBSTANCES | SYMRISE GMBH & CO. KG (DE) | 2007-11-22 | — | — | WO | disclosed |