Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VCP | P55072 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.37 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | MAT2A | P31153 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | METAP2 | P50579 | 1/20 | 0.33 |
| ▸ | METAP1 | P53582 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28487163 | 0.83 | VCP (0.40) | VCPKDM4EALDH1A1HPGDCYP1A2 | |
| SCHEMBL29134980 | 0.73 | MAPT (0.49) | VCPMAPK14BRD4MAPTL3MBTL1 | |
| SCHEMBL28492642 | 0.73 | SLC6A2 (0.45) | VCPTP53RXFP1NOTUMKDM4E | |
| SCHEMBL16597050 | 0.72 | NOTUM (0.47) | TP53RXFP1NOTUMKDM4EMAT2A | |
| SCHEMBL17680605 | 0.72 | GPR3 (0.41) | TP53RXFP1GAANOTUMKDM4E | |
| SCHEMBL28335263 | 0.68 | RPS6KA5 (0.53) | NOTUMKDM4EBRD4LMNAHSP90AA1 | |
| SCHEMBL28484200 | 0.67 | ALDH1A1 (0.44) | RXFP1KDM4EALDH1A1MAPTCYP1A2 | |
| SCHEMBL29134590 | 0.67 | CYP17A1 (0.41) | VCPMAPK14KDM4EMAT2AALDH1A1 | |
| SCHEMBL16484323 | 0.67 | KDM4E (0.50) | KDM4EALDH1A1LMNAMAPTCYP1A2 | |
| SCHEMBL29134588 | 0.66 | KDM4E (0.41) | VCPRXFP1MAPK14KDM4EALDH1A1 |
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-117343044-A | Synthesis method of 2-methyl-1- (pyridine-2-yl) indole compound | 太原理工大学 | 2024-01-05 | — | — | CN | disclosed |