Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRBN | Q96SW2 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | TOP2A | P11388 | 3/20 | 0.35 |
| ▸ | TOP2B | Q02880 | 3/20 | 0.35 |
| ▸ | FKBP5 | Q13451 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.31 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.30 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.30 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.30 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.30 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.30 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.30 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.30 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.30 |
| ▸ | NEK2 | P51955 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14571203 | 0.82 | KDM4E (0.47) | CRBNKDM4EGAAPOLBTOP2A | |
| SCHEMBL2918635 | 0.78 | — | — | |
| N-Methylpiperidine SCHEMBL16059103 | 0.71 | NPSR1 (0.36) | CRBNKDM4EGAAPOLBALDH1A1 | |
| SCHEMBL20417954 | 0.71 | CRBN (0.67) | CRBNKDM4EGAAPOLBTOP2A | |
| SCHEMBL20694664 | 0.69 | CRBN (0.56) | CRBNTOP2ATOP2BNEK2 | |
| SCHEMBL7359122 | 0.69 | CRBN (0.64) | CRBNKDM4EGAAPOLBFKBP5 | |
| SCHEMBL85702 | 0.69 | — | — | |
| N-Methyl Pyrrolidine (Nmp) SCHEMBL6894131 | 0.68 | OR51E2 (0.65) | CRBNKDM4EGAAPOLBFKBP5 | |
| SCHEMBL1101973 | 0.67 | — | — | |
| SCHEMBL2917333 | 0.67 | CRBN (0.46) | CRBNGAATOP2ATOP2BALDH1A1 |
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-2022132200-A1 | AZAQUINAZOLINE PAN-KRAS INHIBITORS | Mirati Therapeutics, Inc. (US) | 2022-06-23 | — | — | WO | disclosed |