Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 2/20 | 0.47 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.47 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.47 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.47 |
| ▸ | PNMT | P11086 | 1/20 | 0.47 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.41 |
| ▸ | NOS3 | P29474 | 1/20 | 0.40 |
| ▸ | NOS1 | P29475 | 1/20 | 0.40 |
| ▸ | NOS2 | P35228 | 1/20 | 0.40 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 7/20 | 0.38 |
| ▸ | HTR2A | P28223 | 3/20 | 0.38 |
| ▸ | HTR2B | P41595 | 3/20 | 0.38 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.37 |
| ▸ | KDM1A | O60341 | 1/20 | 0.37 |
| ▸ | PDE2A | O00408 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16311794 | 1.00 | CHRNB2 (0.47) | CHRNB2CHRNA4CHRNB4CHRNA3PNMT | |
| SCHEMBL3408785 | 0.91 | PTGDR2 (0.51) | CHRNB2CHRNA4CHRNB4CHRNA3PNMT | |
| SCHEMBL15269917 | 0.88 | HTR2C (0.56) | CHRNB2CHRNA4CHRNB4CHRNA3PNMT | |
| SCHEMBL15010912 | 0.85 | ALDH1A1 (0.43) | CHRNB2CHRNA4CHRNB4CHRNA3PNMT | |
| SCHEMBL9882913 | 0.85 | CHRNB2 (0.47) | CHRNB2CHRNA4CHRNB4CHRNA3PNMT | |
| SCHEMBL15269807 | 0.83 | PNMT (0.41) | CHRNB2CHRNA4CHRNB4CHRNA3PNMT | |
| SCHEMBL26795661 | 0.81 | ALDH1A1 (0.36) | — | |
| SCHEMBL15012563 | 0.81 | RBP4 (0.46) | PTGDR2MRGPRX4HTR2A | |
| SCHEMBL11820052 | 0.80 | CHRNB2 (0.41) | CHRNB2CHRNA4CHRNB4CHRNA3PNMT | |
| SCHEMBL17141508 | 0.79 | IDO1 (0.44) | CHRNB2CHRNA4CHRNB4CHRNA3PNMT |
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-119306664-A | Novel heterocyclic compounds as Pol theta inhibitors for the treatment and prevention of cancer and pharmaceutical compositions containing the same | 株式会社大熊制药 | 2025-01-14 | — | — | CN | disclosed |