Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | PPARG | P37231 | 3/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.35 |
| ▸ | RXRA | P19793 | 1/20 | 0.35 |
| ▸ | OXER1 | Q8TDS5 | 1/20 | 0.35 |
| ▸ | FAAH | O00519 | 3/20 | 0.35 |
| ▸ | PRKCA | P17252 | 1/20 | 0.35 |
| ▸ | TERT | O14746 | 3/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | BLM | P54132 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | FABP4 | P15090 | 2/20 | 0.34 |
| ▸ | F7 | P08709 | 2/20 | 0.34 |
| ▸ | F3 | P13726 | 2/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2405490 | 0.89 | ALDH1A1 (0.56) | ALDH1A1PTGS1MAPTPPARGCYP19A1 | |
| SCHEMBL2405491 | 0.89 | ALDH1A1 (0.56) | ALDH1A1PTGS1MAPTPPARGCYP19A1 | |
| SCHEMBL28128284 | 0.80 | MGLL (0.49) | ALDH1A1MAPTPPARGCYP19A1FAAH | |
| SCHEMBL8986098 | 0.79 | PTGS1 (0.36) | ALDH1A1PTGS1TSHRHSD17B10ALOX15 | |
| SCHEMBL3506096 | 0.78 | TSHR (0.52) | ALDH1A1TSHROXER1KMT2ALMNA | |
| SCHEMBL7700884 | 0.78 | TSHR (0.52) | ALDH1A1TSHROXER1KMT2ALMNA | |
| SCHEMBL18339165 | 0.78 | TSHR (0.52) | ALDH1A1TSHROXER1KMT2ALMNA | |
| SCHEMBL523909 | 0.77 | TERT (0.59) | PTGS1MAPTPPARGCYP19A1FAAH | |
| SCHEMBL10445410 | 0.77 | TERT (0.59) | PTGS1MAPTPPARGCYP19A1FAAH | |
| SCHEMBL15226967 | 0.77 | TERT (0.59) | PTGS1MAPTPPARGCYP19A1FAAH |
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 |
|---|---|---|---|---|---|---|---|
| CN-116399995-A | Method for constructing characteristic spectrum of volatile component in hop and method for identifying hop | 华润雪花啤酒（中国）有限公司 | 2023-07-07 | — | — | CN | disclosed |