Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | FLT3 | P36888 | 1/20 | 0.31 |
| ▸ | GCKR | Q14397 | 1/20 | 0.31 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.30 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.30 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.30 |
| ▸ | CNR1 | P21554 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | SSTR5 | P35346 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22650820 | 0.79 | CHRNB2 (0.34) | CHRNB2CHRNA4AKR1C3 | |
| SCHEMBL22650730 | 0.73 | ALOX5AP (0.40) | GCKRCHRNB2CHRNA4AKR1C3 | |
| SCHEMBL22650819 | 0.73 | HRH3 (0.39) | CHRNB2CHRNA4AKR1C3 | |
| SCHEMBL22650822 | 0.72 | CHRNB2 (0.37) | GCKRCHRNB2CHRNA4AKR1C3 | |
| SCHEMBL18291712 | 0.72 | CKS1B (0.45) | CNR1 | |
| SCHEMBL22650368 | 0.70 | ALOX5AP (0.37) | GCKRCHRNB2CHRNA4AKR1C3 | |
| SCHEMBL29462389 | 0.70 | ALOX5AP (0.37) | GCKRCHRNB2CHRNA4AKR1C3 | |
| SCHEMBL22650818 | 0.70 | PIK3CA (0.37) | — | |
| SCHEMBL22650562 | 0.68 | PIK3CA (0.35) | CHRNB2CHRNA4AKR1C3 | |
| SCHEMBL22650566 | 0.67 | DPP4 (0.33) | GCKRCHRNB2CHRNA4AKR1C3 |
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-2020224568-A1 | CDK INHIBITORS | QILU REGOR THERAPEUTICS INC. (CN) | 2020-11-12 | — | — | WO | disclosed |