Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.45 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | SRC | P12931 | 1/20 | 0.40 |
| ▸ | KIF11 | P52732 | 1/20 | 0.39 |
| ▸ | RORA | P35398 | 1/20 | 0.38 |
| ▸ | RORC | P51449 | 1/20 | 0.38 |
| ▸ | RORB | Q92753 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | PPARA | Q07869 | 1/20 | 0.37 |
| ▸ | PDE4A | P27815 | 3/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.36 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30675225 | 1.00 | PTGDR2 (0.45) | PTGDR2AKR1B1KDM4EALOX5SRC | |
| SCHEMBL28628728 | 0.83 | LMNA (0.43) | KDM4EPOLBHTTCYP2C9 | |
| SCHEMBL29123399 | 0.75 | POLB (0.37) | KDM4EALOX5RORCPOLB | |
| SCHEMBL30792537 | 0.74 | LMNA (0.42) | KDM4ERORARORCRORBPOLB | |
| SCHEMBL28626909 | 0.73 | AKR1C3 (0.47) | PTGDR2AKR1B1KDM4EALOX5SRC | |
| SCHEMBL18015724 | 0.73 | KIF11 (0.50) | PTGDR2AKR1B1KDM4EALOX5SRC | |
| SCHEMBL16729412 | 0.72 | KIF11 (0.51) | PTGDR2KDM4ESRCKIF11CYP2C9 | |
| SCHEMBL17968711 | 0.72 | KIF11 (0.49) | PTGDR2KDM4ESRCKIF11RORA | |
| SCHEMBL28637173 | 0.71 | AKR1C3 (0.45) | PTGDR2SRCKIF11AKR1C3CYP2C9 | |
| SCHEMBL4616695 | 0.71 | ALOX5 (0.50) | KDM4EALOX5SRC |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113429332-B | 3-substituted indole derivative, preparation method thereof and application thereof in antitumor drugs | 长春工业大学 | 2023-12-15 | — | — | CN | disclosed |
| CN-113429332-A | 3-substituted indole derivative, preparation method thereof and application thereof in antitumor drugs | 长春工业大学 | 2021-09-24 | — | — | CN | disclosed |