Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK8 | P49336 | 3/20 | 0.43 |
| ▸ | KDM5A | P29375 | 1/20 | 0.41 |
| ▸ | BRD4 | O60885 | 2/20 | 0.41 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.40 |
| ▸ | TNKS | O95271 | 1/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.39 |
| ▸ | SCN10A | Q9Y5Y9 | 2/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | SCN1A | P35498 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.38 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.38 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL19539184 | 1.00 | CDK8 (0.43) | CDK8KDM5ABRD4NTRK1TNKS | |
| SCHEMBL23970943 | 0.81 | CDK8 (0.41) | CDK8KDM5ABRD4NTRK1TNKS | |
| SCHEMBL19531834 | 0.81 | CNR2 (0.40) | KDM5ANTRK1TNKSP2RX7GAA | |
| SCHEMBL27732331 | 0.81 | AXL (0.41) | CDK8KDM5ABRD4NTRK1TNKS | |
| SCHEMBL1855794 | 0.79 | MGAM (0.46) | KDM5ABRD4TNKSPTPN1ALDH1A1 | |
| SCHEMBL1161415 | 0.79 | CDK8 (0.43) | CDK8BRD4GAAALDH1A1MAPT | |
| SCHEMBL30487055 | 0.79 | CDK8 (0.43) | CDK8BRD4GAAALDH1A1MAPT | |
| SCHEMBL19463620 | 0.78 | PIM1 (0.43) | CDK8KDM5ATNKSGAAALDH1A1 | |
| SCHEMBL21179076 | 0.78 | KDM5A (0.37) | CDK8KDM5ABRD4NTRK1TNKS | |
| SCHEMBL19537488 | 0.76 | MAOB (0.44) | CDK8KDM5ABRD4NTRK1SCN10A |
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-115650985-B | Heterocyclic compounds as RET kinase inhibitors | 癌症研究科技有限公司 | 2024-08-02 | — | — | CN | disclosed |
| CN-115650985-A | Heterocyclic compounds as RET kinase inhibitors | 癌症研究科技有限公司 | 2023-01-31 | — | — | CN | disclosed |
| CN-109195972-B | Heterocyclic compounds as RET kinase inhibitors | 癌症研究科技有限公司 | 2022-10-28 | — | — | CN | disclosed |