Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 11/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | CHEK2 | O96017 | 2/20 | 0.36 |
| ▸ | IRAK4 | Q9NWZ3 | 4/20 | 0.35 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.35 |
| ▸ | CCNK | O75909 | 1/20 | 0.35 |
| ▸ | CDK7 | P50613 | 1/20 | 0.35 |
| ▸ | CDK9 | P50750 | 1/20 | 0.35 |
| ▸ | CCNH | P51946 | 1/20 | 0.35 |
| ▸ | MNAT1 | P51948 | 1/20 | 0.35 |
| ▸ | CDK12 | Q9NYV4 | 1/20 | 0.35 |
| ▸ | LCK | P06239 | 1/20 | 0.34 |
| ▸ | LYN | P07948 | 1/20 | 0.34 |
| ▸ | PIM1 | P11309 | 1/20 | 0.34 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.34 |
| ▸ | FLT3 | P36888 | 1/20 | 0.34 |
| ▸ | BLK | P51451 | 1/20 | 0.34 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.34 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.34 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL29005619 | 0.90 | MAOA (0.35) | CHEK1 | |
| Trifluoroacetic Acid SCHEMBL29005459 | 0.84 | CCNK (0.44) | CHEK1KCNH2IRAK4CCNT1CCNK | |
| Trifluoroacetic Acid SCHEMBL29005569 | 0.81 | PARP1 (0.34) | CHEK1KCNH2FLT3ALOX5APFEN1 | |
| Trifluoroacetic Acid SCHEMBL29361361 | 0.79 | CCNT1 (0.48) | CHEK1KCNH2CHEK2IRAK4CCNT1 | |
| Trifluoroacetic Acid SCHEMBL29005450 | 0.79 | HRH4 (0.40) | CHEK1RPS6KB1 | |
| Trifluoroacetic Acid SCHEMBL29005531 | 0.77 | HRH4 (0.41) | CHEK1CHEK2IRAK4CCNT1CCNK | |
| Trifluoroacetic Acid SCHEMBL29005633 | 0.75 | HRH4 (0.40) | KCNH2IRAK4CDK7CCNHMNAT1 | |
| Trifluoroacetic Acid SCHEMBL29005438 | 0.69 | CCNT1 (0.42) | CCNT1CCNKCDK7CDK9CCNH | |
| SCHEMBL25028899 | 0.69 | CCNT1 (0.49) | CHEK1CHEK2CCNT1CCNKCDK7 | |
| Trifluoroacetic Acid SCHEMBL29361498 | 0.69 | CCNT1 (0.42) | CCNT1CCNKCDK7CDK9CCNH |
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-115996926-A | Indole compounds as androgen receptor modulators | 尼多生物科学有限公司 | 2023-04-21 | — | — | CN | disclosed |