Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 4/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.44 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.44 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | CNR1 | P21554 | 1/20 | 0.44 |
| ▸ | DRD4 | P21917 | 1/20 | 0.44 |
| ▸ | HRH2 | P25021 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.44 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.44 |
| ▸ | HRH1 | P35367 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 1/20 | 0.44 |
| ▸ | SCN1A | P35498 | 1/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
| ▸ | SCN7A | Q01118 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL24835091 | 0.84 | PRSS1 (0.47) | ACHEMAPK1PRSS1TPSAB1RAB9A | |
| SCHEMBL14415491 | 0.80 | PRSS1 (0.46) | LMNAPRSS1TPSAB1MAOARAB9A | |
| SCHEMBL19600462 | 0.80 | ALDH1A1 (0.53) | ACHELMNAMAPK1SCN5ACYP1A2 | |
| SCHEMBL24760213 | 0.80 | PRSS1 (0.44) | ACHELMNAMAPK1SCN5APRSS1 | |
| SCHEMBL24760578 | 0.80 | PRSS1 (0.44) | ACHELMNAMAPK1PRSS1TPSAB1 | |
| SCHEMBL16015346 | 0.80 | PRSS1 (0.48) | ACHEMAPK1PRSS1TPSAB1SLC6A3 | |
| SCHEMBL24062673 | 0.79 | PRSS1 (0.47) | ACHEPRSS1TPSAB1CYP1A2RAB9A | |
| SCHEMBL27421358 | 0.78 | CTSK (0.41) | ACHELMNAMAPK1SCN5ACYP1A2 | |
| SCHEMBL21896174 | 0.77 | PRSS1 (0.49) | ACHELMNAMAPK1PRSS1TPSAB1 | |
| SCHEMBL10107202 | 0.77 | ALDH1A1 (0.56) | ACHELMNAMAPK1SLC6A3SIGMAR1 |
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-2022262789-A1 | ANTITUMOR COMPOUND AND USE THEREOF | 明慧医药（杭州）有限公司 | 2022-12-22 | — | — | WO | disclosed |