Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.38 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.38 |
| ▸ | CDC7 | O00311 | 1/20 | 0.37 |
| ▸ | CDK2 | P24941 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | MAPK14 | Q16539 | 7/20 | 0.36 |
| ▸ | CSNK1D | P48730 | 2/20 | 0.36 |
| ▸ | CSNK1E | P49674 | 2/20 | 0.36 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29209703 | 1.00 | ALDH1A1 (0.43) | ALDH1A1HPGDCYP3A4TSHRHSD17B10 | |
| SCHEMBL8786339 | 0.84 | ALDH1A1 (0.43) | ALDH1A1HSD17B10PDCD1CD274CDC7 | |
| SCHEMBL26162645 | 0.78 | PDCD1 (0.37) | PDCD1CD274CDC7CDK2MAPK14 | |
| SCHEMBL27195978 | 0.75 | MAPK14 (0.43) | PDCD1CD274CDC7CDK2MAPK14 | |
| SCHEMBL26162658 | 0.75 | PDCD1 (0.35) | PDCD1CD274CDC7CDK2MAPK14 | |
| SCHEMBL26162654 | 0.75 | PDCD1 (0.38) | PDCD1CD274CDC7CDK2MAPK14 | |
| SCHEMBL26162619 | 0.75 | PDCD1 (0.38) | ALDH1A1PDCD1CD274CDC7CDK2 | |
| SCHEMBL30900891 | 0.74 | ALDH1A1 (0.48) | ALDH1A1HPGDCYP3A4TSHRHSD17B10 | |
| SCHEMBL29209772 | 0.74 | ALDH1A1 (0.48) | ALDH1A1HPGDCYP3A4TSHRHSD17B10 | |
| SCHEMBL30881633 | 0.73 | MAPK14 (0.46) | ALDH1A1HPGDHSD17B10PDCD1CD274 |
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-2024099269-A1 | ARYLAMIDE COMPOUND, PHARMACEUTICAL COMPOSITION COMPRISING SAME, USE THEREOF | 华东师范大学 | 2024-05-16 | — | — | WO | disclosed |