Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK7 | P50613 | 6/20 | 0.59 |
| ▸ | CDK9 | P50750 | 4/20 | 0.59 |
| ▸ | CDK4 | P11802 | 3/20 | 0.59 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | TLR9 | Q9NR96 | 2/20 | 0.43 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.43 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.38 |
| ▸ | CDK2 | P24941 | 6/20 | 0.38 |
| ▸ | NOS1 | P29475 | 2/20 | 0.37 |
| ▸ | NOS2 | P35228 | 2/20 | 0.37 |
| ▸ | CCNE1 | P24864 | 4/20 | 0.36 |
| ▸ | CCNH | P51946 | 4/20 | 0.36 |
| ▸ | MNAT1 | P51948 | 4/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL31064223 | 0.86 | CDK9 (0.45) | CDK7CDK9CDK4TLR9TLR8 | |
| SCHEMBL31064455 | 0.83 | CDK9 (0.66) | CDK7CDK9CDK4MEN1KMT2A | |
| SCHEMBL31064246 | 0.81 | CDK9 (0.58) | CDK7CDK9CDK4MEN1KMT2A | |
| SCHEMBL31064241 | 0.80 | CDK9 (0.54) | CDK7CDK9CDK4MEN1KMT2A | |
| SCHEMBL31064012 | 0.80 | CDK7 (0.71) | CDK7CDK9CDK4MEN1KMT2A | |
| SCHEMBL22437597 | 0.79 | CDK9 (0.61) | CDK7CDK9CDK4MEN1KMT2A | |
| SCHEMBL20971705 | 0.79 | CDK9 (0.66) | CDK7CDK9CDK4MEN1KMT2A | |
| SCHEMBL20971693 | 0.79 | CDK9 (0.66) | CDK7CDK9CDK4MEN1KMT2A | |
| SCHEMBL31064031 | 0.76 | CDK4 (0.55) | CDK7CDK9CDK4MEN1KMT2A | |
| SCHEMBL28895475 | 0.75 | CDK7 (0.57) | CDK7CDK9CDK4MEN1KMT2A |
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-2024175024-A1 | NEW FUSED HETEROCYCLIC COMPOUND AS CDKS INHIBITOR AND USE THEREOF | 杭州德睿智药科技有限公司 | 2024-08-29 | — | — | WO | disclosed |