Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNT1 | O60563 | 1/20 | 0.52 |
| ▸ | CCNK | O75909 | 1/20 | 0.52 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.52 |
| ▸ | CDK2 | P24941 | 1/20 | 0.52 |
| ▸ | CDK9 | P50750 | 1/20 | 0.52 |
| ▸ | CDK12 | Q9NYV4 | 1/20 | 0.52 |
| ▸ | CLK1 | P49759 | 2/20 | 0.49 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.49 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.49 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.49 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.46 |
| ▸ | TDO2 | P48775 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 5/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.45 |
| ▸ | HTR2C | P28335 | 1/20 | 0.45 |
| ▸ | HTR2B | P41595 | 1/20 | 0.45 |
| ▸ | HTR5A | P47898 | 1/20 | 0.45 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL517759 | 1.00 | CCNT1 (0.52) | CCNT1CCNKCCNE1CDK2CDK9 | |
| SCHEMBL29613520 | 0.85 | RPS6KA5 (0.66) | CCNT1CCNKCCNE1CDK2CDK9 | |
| SCHEMBL517461 | 0.85 | RPS6KA5 (0.66) | CCNT1CCNKCCNE1CDK2CDK9 | |
| SCHEMBL517438 | 0.83 | JAK2 (0.55) | CCNT1CCNKCDK9CDK12CLK1 | |
| SCHEMBL22510124 | 0.83 | CDK5 (0.56) | CLK1CDK5CDK5R1RPS6KA5PDGFRB | |
| SCHEMBL23152046 | 0.83 | CLK1 (0.71) | CCNT1CCNKCCNE1CDK2CDK9 | |
| SCHEMBL518282 | 0.83 | CDK5 (0.49) | CLK1CDK5CDK5R1RPS6KA5PDGFRB | |
| SCHEMBL24839575 | 0.83 | CLK1 (0.71) | CCNT1CCNKCCNE1CDK2CDK9 | |
| SCHEMBL30957423 | 0.83 | CDK5 (0.49) | CLK1CDK5CDK5R1RPS6KA5PDGFRB | |
| SCHEMBL30687302 | 0.83 | CLK1 (0.71) | CCNT1CCNKCCNE1CDK2CDK9 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112292378-B | Indole derivative-containing inhibitor, preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2024-02-06 | — | — | CN | disclosed |
| CN-116018141-A | Salt and crystal form containing indole derivatives, and preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2023-04-25 | — | — | CN | disclosed |
| CN-114539226-A | Crystal form containing indole derivative free base and preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2022-05-27 | — | — | CN | disclosed |