Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | HTR6 | P50406 | 3/20 | 0.46 |
| ▸ | RORC | P51449 | 1/20 | 0.46 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.46 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.46 |
| ▸ | GBA1 | P04062 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL30302187 | 0.86 | RORC (0.54) | ALDH1A1TSHRHTR6RORCCYP2D6 | |
| SCHEMBL12253466 | 0.85 | NR1H2 (0.56) | ALDH1A1MAPTHTR6RORCNOD1 | |
| SCHEMBL30302204 | 0.83 | KDM4E (0.44) | ALDH1A1MAPTHTR6CYP2D6TP53 | |
| SCHEMBL30302200 | 0.83 | NR1H2 (0.53) | ALDH1A1MAPTRAB9ARORCNOD1 | |
| SCHEMBL30302197 | 0.76 | KMT2A (0.50) | ALDH1A1TSHRRORCPTGER1LMNA | |
| SCHEMBL30302196 | 0.76 | SLC9A1 (0.47) | ALDH1A1MAPTHTR6RORCNOD1 | |
| SCHEMBL30302191 | 0.76 | RORC (0.51) | ALDH1A1MAPTRAB9ARORCKMT2A | |
| SCHEMBL30302190 | 0.75 | NR1H2 (0.53) | ALDH1A1MAPTNOD1PTGER1LMNA | |
| SCHEMBL30302192 | 0.74 | HTT (0.48) | ALDH1A1MAPTTSHRRORCNOD1 | |
| SCHEMBL30302189 | 0.74 | MAPT (0.54) | ALDH1A1MAPTTSHRHTR6NOD1 |
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-115928114-B | Synthetic method of aromatic hydrocarbon pyrazole compound | 淮北师范大学 | 2023-06-27 | — | — | CN | disclosed |
| CN-115928114-A | Synthetic method of aromatic pyrazole compound | 淮北师范大学 | 2023-04-07 | — | — | CN | disclosed |