Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR7 | P34969 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | PTGER3 | P43115 | 2/20 | 0.38 |
| ▸ | PTGER2 | P43116 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28997274 | 0.85 | AR (0.38) | TDP1ALDH1A1PTGER3PTGER2KDM4E | |
| SCHEMBL28997292 | 0.85 | PTGER2 (0.40) | ALDH1A1PTGER3PTGER2MEN1GAA | |
| SCHEMBL28997141 | 0.85 | RAB9A (0.38) | ALDH1A1PTGER3PTGER2MEN1KMT2A | |
| SCHEMBL28997140 | 0.85 | PTGER2 (0.39) | ALDH1A1PTGER3PTGER2KDM4EMAPT | |
| SCHEMBL30226089 | 0.83 | FAAH (0.41) | ALDH1A1MAPTMEN1GAAKMT2A | |
| SCHEMBL28997149 | 0.83 | FAAH (0.41) | ALDH1A1MAPTMEN1GAAKMT2A | |
| SCHEMBL28997150 | 0.81 | KMT2A (0.41) | ALDH1A1MAPTMEN1GAAKMT2A | |
| SCHEMBL16422721 | 0.80 | HDAC1 (0.49) | HTR7TDP1PTGER3PTGER2CNR2 | |
| SCHEMBL9893023 | 0.80 | PER2 (0.46) | HTR7TDP1ALDH1A1PTGER3PTGER2 | |
| SCHEMBL16422287 | 0.80 | TDP1 (0.44) | HTR7TDP1PTGER3PTGER2MAPT |
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-115894323-A | Method for self-cyclizing cyanation of enaminoaniline compound | 湖北工业大学 | 2023-04-04 | — | — | CN | disclosed |