Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDCD1 | Q15116 | 1/20 | 0.37 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.37 |
| ▸ | PRKCQ | Q04759 | 4/20 | 0.36 |
| ▸ | PRKCD | Q05655 | 4/20 | 0.36 |
| ▸ | HTR6 | P50406 | 2/20 | 0.33 |
| ▸ | CDK4 | P11802 | 1/20 | 0.33 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 2/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.32 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.32 |
| ▸ | DRD4 | P21917 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 2/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
| ▸ | KDM1A | O60341 | 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 | |
|---|---|---|---|---|
| SCHEMBL31475221 | 0.88 | PRKCQ (0.34) | PDCD1CD274PRKCQPRKCDCDK4 | |
| SCHEMBL30786276 | 0.82 | CYP4F2 (0.36) | NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL30786118 | 0.81 | PRKCQ (0.34) | PDCD1CD274PRKCQPRKCDCDK4 | |
| SCHEMBL31475241 | 0.77 | BDKRB1 (0.32) | PDCD1CD274PRKCQPRKCDCDK6 | |
| SCHEMBL30786102 | 0.76 | CHEK1 (0.32) | PDCD1CD274CDK6 | |
| SCHEMBL30786151 | 0.75 | MCHR1 (0.36) | CNR2ACHE | |
| SCHEMBL30786116 | 0.71 | RXRA (0.33) | PRKCQPRKCDCDK4CDK6ACHE | |
| SCHEMBL30786199 | 0.71 | CYP4F2 (0.35) | PRKCQPRKCDCDK4CDK6 | |
| SCHEMBL31517065 | 0.68 | FAAH (0.37) | PRKCQPRKCDSMN1; SMN2 | |
| SCHEMBL31475223 | 0.67 | FAAH (0.34) | PRKCQPRKCDCDK4CDK6CNR2 |
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-2024032584-A1 | PROTEIN TYROSINE KINASE INHIBITOR AND MEDICAL USE THEREOF | 苏州必扬医药科技有限公司 | 2024-02-15 | — | — | WO | disclosed |