Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | ERN1 | O75460 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.41 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.40 |
| ▸ | TYR | P14679 | 1/20 | 0.40 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | PRKDC | P78527 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | EGFR | P00533 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30186532 | 0.81 | CA1 (0.67) | CA1CA2ERN1ALDH1A1TRIM24 | |
| SCHEMBL311610 | 0.81 | CA1 (0.67) | CA1CA2ERN1ALDH1A1TRIM24 | |
| SCHEMBL7029847 | 0.77 | CA1 (0.55) | CA1CA2ERN1ALDH1A1TRIM24 | |
| SCHEMBL24390668 | 0.73 | CA1 (0.55) | CA1CA2ERN1ALDH1A1CYP1A2 | |
| SCHEMBL25857635 | 0.73 | CA1 (0.55) | CA1CA2ALDH1A1TNFRSF1ACYP1A2 | |
| SCHEMBL5961679 | 0.72 | CA1 (0.64) | CA1CA2ALDH1A1KDM4ETSHR | |
| SCHEMBL27534658 | 0.71 | TNFRSF1A (0.39) | CA1CA2ERN1ALDH1A1TRIM24 | |
| SCHEMBL10728453 | 0.70 | ERN1 (0.53) | CA1CA2ERN1ALDH1A1TRIM24 | |
| SCHEMBL28075565 | 0.69 | HTT (0.54) | ERN1ALDH1A1KDM4ETSHRTDP1 | |
| Lithium Ion SCHEMBL6312687 | 0.69 | CA1 (0.59) | CA1CA2ALDH1A1TYRKDM4E |
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-101184744-A | Aroma precursor and flavor precursor composition | FLEXITRAL INC (US) | 2008-05-21 | — | — | CN | disclosed |