Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.40 |
| ▸ | TNF | P01375 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.40 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.40 |
| ▸ | CDK4 | P11802 | 1/20 | 0.39 |
| ▸ | CDK2 | P24941 | 1/20 | 0.39 |
| ▸ | RET | P07949 | 1/20 | 0.39 |
| ▸ | KIF5B | P33176 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | DHODH | Q02127 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29638511 | 0.90 | DYRK1A (0.47) | TRPA1MAPTNCOA1NCOA3RET | |
| SCHEMBL29638530 | 0.82 | HDAC3 (0.44) | GRM4TNFCDK4CDK2RET | |
| SCHEMBL29638533 | 0.81 | NCOA1 (0.60) | MAPTTNFSMN1; SMN2NCOA1NCOA3 | |
| SCHEMBL29638531 | 0.80 | HDAC3 (0.53) | GRM4RETKIF5BKDRHDAC3 | |
| SCHEMBL26210446 | 0.79 | EGFR (0.39) | SMN1; SMN2P2RX7CDK2RETKIF5B | |
| SCHEMBL29638608 | 0.79 | HDAC3 (0.46) | MAPTSMN1; SMN2NPC1RAB9AP2RX7 | |
| Hydrochloric Acid SCHEMBL9378828 | 0.75 | ALDH1A1 (0.44) | SMN1; SMN2CDK2ALDH1A1MAPK1ADRA1D | |
| SCHEMBL25373687 | 0.74 | MAPT (0.40) | MAPTRAB9AP2RX7KDRDHODH | |
| SCHEMBL29638713 | 0.74 | RAPGEF4 (0.41) | TRPA1TNFHDAC3HDAC1HDAC6 | |
| SCHEMBL23624389 | 0.72 | ABL1 (0.49) | TNFNCOA1NCOA3KDRDHODH |
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-2022089219-A1 | ARYLAMIDE COMPOUND, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 四川科伦博泰生物医药股份有限公司 | 2022-05-05 | — | — | WO | disclosed |