Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | AURKA | O14965 | 1/20 | 0.35 |
| ▸ | FLT1 | P17948 | 1/20 | 0.35 |
| ▸ | KDR | P35968 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CASP3 | P42574 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4541810 | 1.00 | ALDH1A1 (0.39) | ALDH1A1RAB9AHSD17B10HPGDKDM4E | |
| SCHEMBL16669877 | 0.91 | HPGD (0.47) | ALDH1A1RAB9AHPGDKDM4ETSHR | |
| SCHEMBL16670450 | 0.81 | TAS1R3 (0.46) | ALDH1A1RAB9AHPGDTSHRNPC1 | |
| SCHEMBL16670166 | 0.81 | TAS1R3 (0.46) | ALDH1A1RAB9AHPGDTSHRNPC1 | |
| SCHEMBL16670168 | 0.81 | TAS1R3 (0.46) | ALDH1A1RAB9AHPGDTSHRNPC1 | |
| SCHEMBL6448020 | 0.80 | ALDH1A1 (0.43) | ALDH1A1RAB9AHSD17B10KDM4ETP53 | |
| SCHEMBL6458503 | 0.80 | ALDH1A1 (0.43) | ALDH1A1RAB9AHSD17B10HPGDKDM4E | |
| SCHEMBL16671758 | 0.71 | HPGD (0.49) | ALDH1A1RAB9AHPGDKDM4ETSHR | |
| SCHEMBL29679416 | 0.71 | HPGD (0.49) | ALDH1A1RAB9AHPGDKDM4ETSHR | |
| SCHEMBL6450022 | 0.71 | HPGD (0.49) | ALDH1A1RAB9AHPGDKDM4ETSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012065062-A1 | NOVEL ANTIVIRAL COMPOUNDS | PHARMARESOURCES(SHANGHAI)CO., LTD. (CN) | 2012-05-18 | — | — | WO | disclosed |