Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 8/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 7/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.34 |
| ▸ | TACR1 | P25103 | 5/20 | 0.33 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.33 |
| ▸ | PLAT | P00750 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.32 |
| ▸ | RELA | Q04206 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28329578 | 0.92 | SLC6A4 (0.39) | SLC6A4SLC6A2SLC6A3CYP2D6CHRM3 | |
| SCHEMBL29017156 | 0.89 | GPR119 (0.38) | SLC6A4SLC6A2SLC6A3TACR1GPR119 | |
| SCHEMBL2597129 | 0.83 | EP300 (0.34) | SLC6A4SLC6A2SLC6A3TACR1PLAT | |
| SCHEMBL529996 | 0.78 | SLC6A4 (0.36) | SLC6A4SLC6A2SLC6A3CYP2D6CHRM3 | |
| SCHEMBL27884240 | 0.76 | SMN1; SMN2 (0.47) | ALDH1A1 | |
| SCHEMBL2351678 | 0.76 | TACR1 (0.36) | SLC6A4SLC6A2SLC6A3TACR1GPR119 | |
| SCHEMBL12469312 | 0.76 | SLC6A2 (0.46) | SLC6A4SLC6A2SLC6A3TACR1CYP2D6 | |
| SCHEMBL30502020 | 0.75 | GPR119 (0.40) | SLC6A4SLC6A2SLC6A3TACR1GPR119 | |
| SCHEMBL17560116 | 0.75 | TACR1 (0.41) | SLC6A4SLC6A2SLC6A3TACR1CYP2D6 | |
| SCHEMBL9900211 | 0.74 | TACR1 (0.32) | SLC6A4SLC6A2SLC6A3TACR1PLAT |
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-2023227125-A1 | NEW FUSED-HETEROCYCLIC COMPOUND AS CDK INHIBITOR AND USE THEREOF | 杭州德睿智药科技有限公司 | 2023-11-30 | — | — | WO | disclosed |