Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM5A | P29375 | 1/20 | 0.32 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.32 |
| ▸ | MGLL | Q99685 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 3/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 2/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | JAK3 | P52333 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL38657830 | 0.74 | ALDH1A1 (0.47) | TSHRHSD17B10HPGDMAPK1ALDH1A1 | |
| SCHEMBL30449933 | 0.73 | ALDH1A1 (0.50) | TSHRHSD17B10HPGDMAPK1ALDH1A1 | |
| SCHEMBL5815964 | 0.66 | — | — | |
| SCHEMBL29152644 | 0.65 | SMN1; SMN2 (0.33) | TSHRHSD17B10CYP2C9ALDH1A1 | |
| SCHEMBL28326518 | 0.65 | SMN1; SMN2 (0.33) | TSHRHSD17B10CYP2C9ALDH1A1 | |
| SCHEMBL30978268 | 0.65 | CHRNB2 (0.30) | — | |
| Ammonia Solution, Strong SCHEMBL28154471 | 0.65 | SMN1; SMN2 (0.33) | TSHRHSD17B10CYP2C9ALDH1A1 | |
| SCHEMBL932957 | 0.64 | GRIN2B (0.43) | HSD17B10HPGDJAK3 | |
| SCHEMBL11037870 | 0.63 | — | — | |
| SCHEMBL27790691 | 0.62 | ELANE (0.38) | — |
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-117769443-A | Fibroblast activation protein inhibitor and use thereof | 3B制药有限公司 | 2024-03-26 | — | — | CN | disclosed |