Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 2/20 | 0.41 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.38 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.38 |
| ▸ | CDK1 | P06493 | 1/20 | 0.38 |
| ▸ | CDK2 | P24941 | 1/20 | 0.38 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.37 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.37 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.37 |
| ▸ | NOS2 | P35228 | 2/20 | 0.36 |
| ▸ | VCP | P55072 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.36 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.35 |
| ▸ | RELA | Q04206 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12395279 | 0.71 | S1PR1 (0.59) | HPGDKDM4ENPC1HTTRAB9A | |
| SCHEMBL29109555 | 0.69 | DDX3X (0.40) | AOC3KDM4ENPC1NFKB1HTT | |
| SCHEMBL2384178 | 0.69 | BACE1 (0.51) | NOS2VCPKDM4ETDP1NOS3 | |
| SCHEMBL16432027 | 0.68 | MAP4K4 (0.53) | MKNK1MKNK2CDK1CDK2NOS2 | |
| SCHEMBL12474028 | 0.68 | MKNK1 (0.51) | MKNK1MKNK2RPS6KA5NOS2HPGD | |
| SCHEMBL26108844 | 0.68 | NR1H2 (0.50) | NR1H2NR1H3KDM4ENPC1NFKB1 | |
| SCHEMBL31228708 | 0.68 | NR1H2 (0.50) | NR1H2NR1H3KDM4ENPC1NFKB1 | |
| SCHEMBL7324860 | 0.67 | ALPL (0.46) | MKNK1MKNK2CDK1CDK2HPGD | |
| SCHEMBL7659462 | 0.67 | DDX3X (0.43) | NR1H2NR1H3TLR8ALPL | |
| SCHEMBL27880002 | 0.67 | SMN1; SMN2 (0.56) | HPGDKDM4ENPC1NFKB1HTT |
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 |
|---|---|---|---|---|---|---|---|
| CN-113227070-A | ASK1 inhibitors | 比奥根MA公司 | 2021-08-06 | — | — | CN | disclosed |