Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC9A1 | P19634 | 1/20 | 0.46 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.44 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.38 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL22666874 | 1.00 | SLC9A1 (0.46) | SLC9A1KEAP1NFE2L2CYP3A4ALDH1A1 | |
| SCHEMBL23674344 | 0.86 | SLC9A1 (0.61) | SLC9A1KEAP1NFE2L2CYP3A4ALDH1A1 | |
| SCHEMBL24755247 | 0.84 | SLC9A1 (0.50) | SLC9A1ALDH1A1CASP1POLBKDM4E | |
| SCHEMBL7540414 | 0.82 | KEAP1 (0.46) | KEAP1NFE2L2ALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL29406550 | 0.81 | KEAP1 (0.64) | KEAP1NFE2L2ALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL2566963 | 0.81 | KEAP1 (0.64) | KEAP1NFE2L2ALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL24659358 | 0.81 | KEAP1 (0.42) | SLC9A1KEAP1NFE2L2CYP3A4ALDH1A1 | |
| SCHEMBL20298359 | 0.81 | ALDH1A1 (0.46) | SLC9A1KEAP1NFE2L2CYP3A4ALDH1A1 | |
| SCHEMBL25501974 | 0.81 | KEAP1 (0.42) | SLC9A1KEAP1NFE2L2CYP3A4ALDH1A1 | |
| SCHEMBL20296487 | 0.81 | SLC9A1 (0.44) | SLC9A1KEAP1NFE2L2CYP3A4ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022262686-A1 | KRAS G12D INHIBITORS | JINGRUI BIOPHARMA CO., LTD. (CN) | 2022-12-22 | — | — | WO | disclosed |
| WO-2022171191-A1 | COMPOUNDS AS ANTICANCER AGENTS | JINGRUI BIOPHARMA CO., LTD. (CN) | 2022-08-18 | — | — | WO | disclosed |