Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL1874741 | 0.83 | CYP1A2 (0.39) | THRBNPC1ALDH1A1TP53MAPT | |
| SCHEMBL5897591 | 0.80 | CYP1A2 (0.39) | THRBNPC1ALDH1A1TP53MAPT | |
| SCHEMBL14635952 | 0.75 | HSD11B1 (0.31) | — | |
| SCHEMBL1869315 | 0.73 | ALDH1A1 (0.41) | ALDH1A1TP53MAPTTSHRMAPK1 | |
| SCHEMBL10779350 | 0.70 | BRD4 (0.39) | — | |
| SCHEMBL6559191 | 0.66 | CYP1A2 (0.36) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL5897138 | 0.66 | CYP1A2 (0.38) | NPC1ALDH1A1TSHRMAPK1HTT | |
| SCHEMBL9494811 | 0.65 | NPC1 (0.30) | NPC1RAB9ANPSR1 | |
| SCHEMBL874374 | 0.64 | CES2 (0.48) | NPC1ALDH1A1HTTRAB9ASMN1; SMN2 | |
| SCHEMBL7614074 | 0.63 | MAPK1 (0.45) | THRBMAPK1 |
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-112480121-A | Polycyclic derivative and preparation thereof | 四川海思科制药有限公司 | 2021-03-12 | — | — | CN | disclosed |