Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.38 |
| ▸ | NOS2 | P35228 | 1/20 | 0.38 |
| ▸ | MPO | P05164 | 1/20 | 0.38 |
| ▸ | TPO | P07202 | 1/20 | 0.38 |
| ▸ | EPX | P11678 | 1/20 | 0.38 |
| ▸ | LPO | P22079 | 1/20 | 0.38 |
| ▸ | TRPC6 | Q9Y210 | 3/20 | 0.37 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.36 |
| ▸ | FEN1 | P39748 | 1/20 | 0.36 |
| ▸ | ABL1 | P00519 | 1/20 | 0.36 |
| ▸ | LTA4H | P09960 | 1/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.35 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 2/20 | 0.34 |
| ▸ | DRD3 | P35462 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27211391 | 1.00 | NOS3 (0.38) | NOS3NOS2MPOTPOEPX | |
| SCHEMBL1000603 | 0.85 | NOS3 (0.46) | NOS3NOS2MPOTPOEPX | |
| Hydrochloric Acid SCHEMBL710140 | 0.83 | NOS3 (0.45) | NOS3NOS2MPOTPOEPX | |
| SCHEMBL32667064 | 0.79 | CHRNB2 (0.44) | ABL1CHRNB4CHRNA3CHRNB2CHRNA4 | |
| SCHEMBL30618232 | 0.78 | ALDH1A1 (0.45) | ALOX5APFEN1ALDH1A1 | |
| SCHEMBL31224841 | 0.76 | TDP1 (0.43) | CHRNB4CHRNA3KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL5501415 | 0.76 | TDP1 (0.43) | CHRNB4CHRNA3KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL31224596 | 0.76 | TDP1 (0.43) | CHRNB4CHRNA3KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL1769428 | 0.75 | CHRNB2 (0.42) | MPOTPOEPXLPOCHRNB4 | |
| SCHEMBL1769225 | 0.75 | CHRNB2 (0.42) | NOS3NOS2MPOTPOEPX |
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-116390917-A | MRGX2 antagonists | 葛兰素史密斯克莱知识产权发展有限公司 | 2023-07-04 | — | — | CN | disclosed |