Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 1/20 | 0.37 |
| ▸ | TDO2 | P48775 | 2/20 | 0.36 |
| ▸ | LIMK1 | P53667 | 2/20 | 0.36 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.36 |
| ▸ | CSF1R | P07333 | 1/20 | 0.36 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.36 |
| ▸ | PDGFRA | P16234 | 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 | |
|---|---|---|---|---|
| SCHEMBL28815370 | 1.00 | ALDH1A1 (0.39) | ALDH1A1HSD17B10KDM4EHPGDMAPT | |
| SCHEMBL21097451 | 0.84 | GRM5 (0.49) | ALDH1A1HSD17B10KDM4EHPGDMAPT | |
| SCHEMBL20791596 | 0.81 | MAPT (0.40) | ALDH1A1HSD17B10KDM4EHPGDMAPT | |
| SCHEMBL21451361 | 0.81 | PDCD1 (0.43) | ALDH1A1HSD17B10KDM4EHPGDMAPT | |
| SCHEMBL2856342 | 0.81 | ALDH1A1 (0.40) | ALDH1A1HSD17B10KDM4EHPGDMAPT | |
| SCHEMBL5354381 | 0.80 | ALDH1A1 (0.42) | ALDH1A1HSD17B10KDM4EHPGDMAPT | |
| SCHEMBL10535351 | 0.76 | TSHR (0.45) | ALDH1A1HSD17B10KDM4EHPGDMAPT | |
| SCHEMBL30210978 | 0.75 | NPC1 (0.38) | ALDH1A1HSD17B10KDM4EHPGDMAPT | |
| SCHEMBL27468177 | 0.75 | CD44 (0.43) | ALDH1A1HSD17B10KDM4EHPGDMAPT | |
| SCHEMBL28815369 | 0.74 | ALDH1A1 (0.48) | ALDH1A1HSD17B10KDM4EHPGDMAPT |
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-113861226-B | Ultra-carbon gold cluster ionic compound and preparation method and application thereof | 清华大学 | 2022-08-19 | — | — | CN | disclosed |