Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.36 |
| ▸ | NOS2 | P35228 | 1/20 | 0.36 |
| ▸ | KAT2B | Q92831 | 2/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | CPB2 | Q96IY4 | 2/20 | 0.33 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.32 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.32 |
| ▸ | ALPL | P05186 | 1/20 | 0.32 |
| ▸ | NOS1 | P29475 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.31 |
| ▸ | MTOR | P42345 | 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 | |
|---|---|---|---|---|
| SCHEMBL4702511 | 0.81 | CA12 (0.38) | KAT2BCA12CA1CA2CA9 | |
| SCHEMBL16963191 | 0.73 | HRH3 (0.47) | NOS3NOS2NOS1 | |
| SCHEMBL11875787 | 0.73 | MAPT (0.46) | KAT2BADRA2BADRA2C | |
| SCHEMBL2487033 | 0.73 | ADRA2A (0.53) | NOS3NOS2ADRA2AADRA2BADRA2C | |
| SCHEMBL22175094 | 0.72 | MAPT (0.38) | NOS3NOS2KAT2BCPB2ADRA2A | |
| SCHEMBL28324750 | 0.71 | KDM4E (0.43) | KMT2A | |
| SCHEMBL2483169 | 0.70 | NOS3 (0.45) | NOS3NOS2CPB2ALPLPIK3CA | |
| SCHEMBL20929322 | 0.69 | MAPT (0.42) | NOS3NOS2ADRA2AADRA2BADRA2C | |
| SCHEMBL5694416 | 0.68 | MAOA (0.43) | NOS3NOS2PIK3CAMTOR | |
| SCHEMBL11214950 | 0.68 | MAPT (0.57) | MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-110357885-A | A kind of pteridine compounds and its application pharmaceutically | 江南大学 | 2019-10-22 | — | — | CN | disclosed |