Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.44 |
| ▸ | CRHBP | P24387 | 1/20 | 0.44 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.44 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 2/20 | 0.42 |
| ▸ | EP300 | Q09472 | 2/20 | 0.42 |
| ▸ | KAT8 | Q9H7Z6 | 2/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.42 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6554889 | 0.98 | ALDH1A1 (0.44) | ALDH1A1HPGDCYP3A4TSHRHSD17B10 | |
| SCHEMBL247570 | 0.92 | ALDH1A1 (0.50) | ALDH1A1HPGDCYP3A4TSHRHSD17B10 | |
| Hydrochloric Acid SCHEMBL17063707 | 0.90 | ALDH1A1 (0.48) | ALDH1A1HPGDCYP3A4TSHRHSD17B10 | |
| SCHEMBL25821914 | 0.88 | ALDH1A1 (0.52) | ALDH1A1HPGDCYP3A4TSHRHSD17B10 | |
| SCHEMBL30881868 | 0.83 | ALDH1A1 (0.56) | ALDH1A1HPGDCYP3A4TSHRHSD17B10 | |
| SCHEMBL30735695 | 0.83 | HTR6 (0.54) | ALDH1A1HPGDCYP3A4TSHRHSD17B10 | |
| SCHEMBL19284562 | 0.83 | HTR6 (0.54) | ALDH1A1HPGDCYP3A4TSHRHSD17B10 | |
| Hydrochloric Acid SCHEMBL19284717 | 0.82 | HTR2C (0.53) | ALDH1A1HPGDCYP3A4TSHRHSD17B10 | |
| SCHEMBL8117529 | 0.80 | DRD2 (0.47) | ALDH1A1HPGDCYP3A4TSHRHSD17B10 | |
| SCHEMBL11007946 | 0.76 | IDO1 (0.52) | ALDH1A1HPGDTSHRHSD17B10TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1214345-B1 | AGENTS FOR TREATING HUMAN DISEASES, ESPECIALLY FOR TREATING TUMORS SUCH AS COLONIC CANCERS AND MELANOMAS OR FOR REGENERATING TISSUE AND PROMOTING HAIR GROWTH | MAX DELBRUECK CENTRUM (DE) | 2004-12-29 | — | — | EP | claimed |