Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.41 |
| ▸ | MGAM | O43451 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | SI | P14410 | 1/20 | 0.39 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4984393 | 0.83 | MGAM (0.46) | ALDH1A1CYP3A4ALOX15HSD17B10CHRM1 | |
| Succinic Acid Diethyl Ester SCHEMBL10467318 | 0.78 | ALDH1A1 (0.42) | ALDH1A1CYP3A4ALOX15HSD17B10CHRM1 | |
| SCHEMBL18196133 | 0.76 | MGAM (0.36) | ALDH1A1CYP3A4ALOX15HSD17B10CHRM1 | |
| SCHEMBL21022968 | 0.76 | MGAM (0.36) | ALDH1A1CYP3A4ALOX15HSD17B10CHRM1 | |
| SCHEMBL10636719 | 0.75 | LMNA (0.46) | ALDH1A1CYP3A4ALOX15HSD17B10MGAM | |
| SCHEMBL1245715 | 0.75 | ALDH1A1 (0.50) | ALDH1A1CYP3A4ALOX15HSD17B10CHRM1 | |
| SCHEMBL22040635 | 0.75 | MGAM (0.46) | ALDH1A1CYP3A4ALOX15HSD17B10CHRM1 | |
| SCHEMBL10011095 | 0.75 | ALDH1A1 (0.38) | ALDH1A1CYP3A4ALOX15HSD17B10CHRM1 | |
| SCHEMBL5267357 | 0.75 | ALDH1A1 (0.38) | ALDH1A1CYP3A4ALOX15HSD17B10CHRM1 | |
| SCHEMBL13136942 | 0.73 | ALDH1A1 (0.53) | ALDH1A1CYP3A4ALOX15HSD17B10CHRM1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5079023-A | During consumption; beverages | HERCULES INCORPORATED (US) | 1992-01-07 | — | — | US | disclosed |
| US-4280011-A | FLAVORINGS | HERCULES INCORPORATED (US) | 1981-07-21 | — | — | US | disclosed |