Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.64 |
| ▸ | MEN1 | O00255 | 2/20 | 0.64 |
| ▸ | USP2 | O75604 | 2/20 | 0.64 |
| ▸ | TP53 | P04637 | 2/20 | 0.64 |
| ▸ | HPGD | P15428 | 2/20 | 0.64 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.64 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.64 |
| ▸ | LMNA | P02545 | 1/20 | 0.64 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.64 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.64 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.64 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.64 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.64 |
| ▸ | NQO1 | P15559 | 1/20 | 0.53 |
| ▸ | CDC25A | P30304 | 6/20 | 0.47 |
| ▸ | CDC25C | P30307 | 6/20 | 0.47 |
| ▸ | ARSA | P15289 | 1/20 | 0.47 |
| ▸ | IDO1 | P14902 | 3/20 | 0.41 |
| ▸ | CDC25B | P30305 | 3/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2957612 | 1.00 | ALDH1A1 (0.64) | ALDH1A1MEN1USP2TP53HPGD | |
| SCHEMBL33372528 | 0.82 | ALDH1A1 (0.82) | ALDH1A1MEN1USP2TP53HPGD | |
| SCHEMBL64776 | 0.82 | ALDH1A1 (0.82) | ALDH1A1MEN1USP2TP53HPGD | |
| SCHEMBL893374 | 0.78 | ALDH1A1 (1.00) | ALDH1A1MEN1USP2TP53HPGD | |
| SCHEMBL30702421 | 0.78 | ALDH1A1 (1.00) | ALDH1A1MEN1USP2TP53HPGD | |
| Anthracene SCHEMBL11125352 | 0.75 | CDC25B (0.74) | ALDH1A1MEN1USP2TP53HPGD | |
| SCHEMBL7213583 | 0.75 | CES1 (0.72) | ALDH1A1MEN1USP2TP53HPGD | |
| SCHEMBL1270918 | 0.74 | ALOX15 (0.41) | ALDH1A1MEN1USP2TP53HPGD | |
| SCHEMBL87570 | 0.74 | CES1 (0.70) | ALDH1A1MEN1USP2TP53HPGD | |
| SCHEMBL7654790 | 0.73 | CDC25B (0.55) | ALDH1A1MEN1USP2TP53HPGD |
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-3966344-A1 | KINASE SCREENING ASSAYS | University of Newcastle Upon Tyne (GB) | 2022-03-16 | — | — | EP | claimed |