Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | GAA | P10253 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | PKM | P14618 | 2/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.33 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30554739 | 1.00 | ALDH1A1 (0.36) | ALDH1A1ALOX15HPGDHSD17B10TDP1 | |
| SCHEMBL30554742 | 0.85 | GABRA1 (0.36) | ALDH1A1ALOX15HPGDHSD17B10TDP1 | |
| SCHEMBL29227264 | 0.85 | GABRA1 (0.36) | ALDH1A1ALOX15HPGDHSD17B10TDP1 | |
| SCHEMBL1803645 | 0.81 | NR1I2 (0.38) | NR1I2CYP1A2ERBB2FYNMAOA | |
| SCHEMBL31337700 | 0.79 | CYP1A2 (0.50) | ALDH1A1ALOX15HPGDHSD17B10TDP1 | |
| SCHEMBL19923803 | 0.79 | CYP1A2 (0.50) | ALDH1A1ALOX15HPGDHSD17B10TDP1 | |
| SCHEMBL31337703 | 0.79 | CYP1A2 (0.50) | ALDH1A1ALOX15HPGDHSD17B10TDP1 | |
| SCHEMBL242040 | 0.77 | CYP1A2 (0.36) | ALDH1A1HPGDHSD17B10TDP1GABRA1 | |
| SCHEMBL29773086 | 0.77 | CYP1A2 (0.36) | ALDH1A1HPGDHSD17B10TDP1GABRA1 | |
| SCHEMBL6354584 | 0.75 | GABRA1 (0.43) | ALDH1A1ALOX15HPGDHSD17B10TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116535293-A | Y-type bromopyrene intermediate and derivative, preparation method and application thereof | 广东工业大学 | 2023-08-04 | — | — | CN | claimed |
| CN-116535293-A | Y-type bromopyrene intermediate and derivative, preparation method and application thereof | 广东工业大学 | 2023-08-04 | — | — | CN | disclosed |