Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | HPRT1 | P00492 | 2/20 | 0.44 |
| ▸ | PTPN22 | Q9Y2R2 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | EP300 | Q09472 | 1/20 | 0.39 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.39 |
| ▸ | KAT8 | Q9H7Z6 | 1/20 | 0.39 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL12734305 | 0.77 | PTPN22 (0.56) | ALDH1A1HSD17B10TSHRHPGDCYP2A6 | |
| SCHEMBL29952231 | 0.77 | PTPN22 (0.56) | ALDH1A1HSD17B10TSHRHPGDCYP2A6 | |
| SCHEMBL5432699 | 0.77 | CYP2A6 (0.46) | ALDH1A1HSD17B10TSHRHPGDCYP3A4 | |
| SCHEMBL29993985 | 0.75 | POLB (0.45) | ALDH1A1HSD17B10TSHRCYP2A6TDP1 | |
| SCHEMBL5773829 | 0.75 | HSD17B10 (0.44) | ALDH1A1HSD17B10TSHRCYP2A6TDP1 | |
| SCHEMBL29234084 | 0.75 | CYP2A6 (0.54) | ALDH1A1HSD17B10TSHRCYP3A4CYP2A6 | |
| SCHEMBL2151120 | 0.75 | TSHR (0.54) | ALDH1A1HSD17B10TSHRHPGDCYP3A4 | |
| SCHEMBL22584748 | 0.75 | HSD17B10 (0.44) | ALDH1A1HSD17B10TSHRCYP2A6TDP1 | |
| SCHEMBL20984005 | 0.75 | HSD17B10 (0.44) | ALDH1A1HSD17B10TSHRCYP2A6TDP1 | |
| SCHEMBL29950886 | 0.75 | HSD17B10 (0.44) | ALDH1A1HSD17B10TSHRCYP2A6TDP1 |
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-115304493-A | Compound and application thereof | 北京鼎材科技有限公司 | 2022-11-08 | — | — | CN | disclosed |
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |