Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 4/20 | 0.47 |
| ▸ | ALOX5 | P09917 | 4/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | HTR6 | P50406 | 6/20 | 0.41 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.41 |
| ▸ | KLK7 | P49862 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | KDM1A | O60341 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR7 | P34969 | 1/20 | 0.40 |
| ▸ | EED | O75530 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28436678 | 0.94 | PTGDR2 (0.48) | PTGDR2ALOX5PTGS2HTR6PTGDR | |
| SCHEMBL28442750 | 0.89 | PTGDR2 (0.46) | PTGDR2ALOX5PTGS2HTR6KLK7 | |
| SCHEMBL28450726 | 0.88 | PPARG (0.45) | ALOX5PTGS2HTR6KLK7LMNA | |
| SCHEMBL16680232 | 0.85 | KDM1A (0.47) | ALOX5PTGS2HTR6KDM1AMAOA | |
| SCHEMBL30831360 | 0.85 | KDM1A (0.47) | ALOX5PTGS2HTR6KDM1AMAOA | |
| SCHEMBL5790264 | 0.83 | HTR6 (0.49) | PTGDR2HTR6PTGDRLMNAHTR2A | |
| SCHEMBL12748700 | 0.82 | PTGDR2 (0.54) | PTGDR2ALOX5PTGS2HTR6KLK7 | |
| SCHEMBL28438741 | 0.82 | KDM1A (0.46) | ALOX5PTGS2HTR6KLK7LMNA | |
| SCHEMBL28442164 | 0.81 | HTR6 (0.53) | PTGDR2HTR6KLK7CYP3A4CYP2D6 | |
| SCHEMBL28896757 | 0.80 | HTR6 (0.52) | PTGDR2HTR6KLK7CYP3A4CYP2D6 |
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-111533738-A | Compound containing indole structure or pharmaceutically acceptable salt thereof, preparation method and application | 中国药科大学 | 2020-08-14 | — | — | CN | disclosed |