Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 5/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 4/20 | 0.36 |
| ▸ | GRM5 | P41594 | 5/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.32 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29755026 | 0.84 | ATAD2 (0.38) | GRM5ATAD2KMT2ACNR2 | |
| SCHEMBL24676542 | 0.75 | SMN1; SMN2 (0.30) | RAB9ASMN1; SMN2 | |
| SCHEMBL8345825 | 0.70 | RAB9A (0.51) | RAB9ASMN1; SMN2ALDH1A1NPC1GRM5 | |
| SCHEMBL30792012 | 0.70 | PPM1D (0.33) | — | |
| SCHEMBL29985897 | 0.69 | ALDH1A1 (0.43) | SMN1; SMN2ALDH1A1KDM4EGAA | |
| SCHEMBL31324578 | 0.68 | KDM4E (0.43) | ALDH1A1KDM4E | |
| SCHEMBL29985993 | 0.68 | KDM4E (0.43) | ALDH1A1KDM4E | |
| SCHEMBL31324566 | 0.68 | ALDH1A1 (0.43) | SMN1; SMN2ALDH1A1KDM4EGAAKMT2A | |
| SCHEMBL29985420 | 0.68 | ALDH1A1 (0.43) | RAB9ASMN1; SMN2ALDH1A1NPC1KDM4E | |
| SCHEMBL29986534 | 0.68 | KDM4E (0.43) | ALDH1A1KDM4E |
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-2022155941-A1 | CDK2 INHIBITORS | QILU REGOR THERAPEUTICS INC. (CN) | 2022-07-28 | — | — | WO | disclosed |