Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NCF1 | P14598 | 1/20 | 0.56 |
| ▸ | MC4R | P32245 | 1/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 6/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 5/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 4/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | WDR5 | P61964 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | DRD4 | P21917 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4598726 | 0.79 | NCF1 (0.56) | NCF1MEN1USP2GAAKMT2A | |
| SCHEMBL13999773 | 0.78 | ADRB1 (0.47) | ADRA2CADRA2AADRA2BWDR5KMT2A | |
| SCHEMBL30607567 | 0.77 | TRPV1 (0.41) | NCF1ADRA2CADRA2AADRA2BMEN1 | |
| SCHEMBL29505669 | 0.77 | NCF1 (0.87) | NCF1ADRA2CHRH3BRD4GAA | |
| SCHEMBL110927 | 0.77 | NCF1 (0.87) | NCF1ADRA2CHRH3BRD4GAA | |
| SCHEMBL2459075 | 0.76 | NCF1 (0.49) | NCF1MC4RADRA2CADRA2AADRA2B | |
| SCHEMBL2459077 | 0.76 | NCF1 (0.49) | NCF1MC4RADRA2CADRA2AADRA2B | |
| SCHEMBL24018758 | 0.74 | MEN1 (0.62) | NCF1MC4RMEN1USP2GAA | |
| SCHEMBL16814948 | 0.74 | NCF1 (0.50) | NCF1MC4RHRH3BRD4MEN1 | |
| SCHEMBL23123509 | 0.74 | ADRA2C (0.44) | ADRA2CADRA2AADRA2BWDR5BRD4 |
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-2023186065-A1 | A CYCLIN-DEPENDENT KINASE INHIBITOR | Taizhou Eoc Pharma Co., Ltd. (CN) | 2023-10-05 | — | — | WO | disclosed |