Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP2K1 | Q02750 | 3/20 | 0.56 |
| ▸ | RAF1 | P04049 | 2/20 | 0.56 |
| ▸ | SRC | P12931 | 7/20 | 0.55 |
| ▸ | EGFR | P00533 | 3/20 | 0.52 |
| ▸ | HPGDS | O60760 | 1/20 | 0.49 |
| ▸ | ABL1 | P00519 | 1/20 | 0.46 |
| ▸ | BCR | P11274 | 1/20 | 0.46 |
| ▸ | PPARG | P37231 | 1/20 | 0.46 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.46 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.46 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.46 |
| ▸ | NQO1 | P15559 | 1/20 | 0.45 |
| ▸ | NMT1 | P30419 | 1/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.43 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.43 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4744297 | 0.88 | MAP2K1 (0.56) | MAP2K1RAF1SRCEGFRHPGDS | |
| SCHEMBL3272746 | 0.84 | SRC (0.60) | MAP2K1RAF1SRCEGFRHPGDS | |
| SCHEMBL3273442 | 0.84 | MAP2K1 (0.55) | MAP2K1RAF1SRCEGFRHPGDS | |
| SCHEMBL28264974 | 0.84 | MAP2K1 (0.55) | MAP2K1RAF1SRCEGFRHPGDS | |
| SCHEMBL3272022 | 0.84 | MAP2K1 (0.55) | MAP2K1RAF1SRCEGFRHPGDS | |
| SCHEMBL13865282 | 0.82 | POLB (0.47) | EGFRNPSR1KDM4EMAPT | |
| SCHEMBL16480634 | 0.81 | MAP2K1 (0.53) | MAP2K1RAF1SRCEGFRHPGDS | |
| SCHEMBL26400641 | 0.81 | MAP2K1 (0.53) | MAP2K1RAF1SRCEGFRHPGDS | |
| SCHEMBL3273397 | 0.80 | MAP2K1 (0.52) | MAP2K1RAF1SRCEGFRHPGDS | |
| SCHEMBL4743752 | 0.78 | SRC (0.62) | MAP2K1SRCEGFRERBB2 |
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-2021225969-A1 | IMINO SULFANONE INHIBITORS OF ENPP1 | VOLASTRA THERAPEUTICS, INC. (US) | 2021-11-11 | — | — | WO | disclosed |