Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.62 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | PDE4A | P27815 | 1/20 | 0.35 |
| ▸ | PGD | P52209 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
| ▸ | RECQL | P46063 | 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 | |
|---|---|---|---|---|
| SCHEMBL9862728 | 1.00 | TSHR (0.62) | TSHRTP53HTTCYP2C9PDE4A | |
| SCHEMBL1397720 | 1.00 | TSHR (0.62) | TSHRTP53HTTCYP2C9PDE4A | |
| SCHEMBL14742965 | 0.97 | TSHR (0.59) | TSHRTP53HTTCYP2C9PDE4A | |
| SCHEMBL9439905 | 0.94 | TSHR (0.56) | TSHRTP53HTTCYP2C9PDE4A | |
| SCHEMBL7992773 | 0.94 | TSHR (0.56) | TSHRTP53HTTCYP2C9PDE4A | |
| SCHEMBL1580351 | 0.94 | TSHR (0.56) | TSHRTP53HTTCYP2C9PDE4A | |
| Water SCHEMBL28238706 | 0.92 | TSHR (0.53) | TSHRTP53HTTCYP2C9PDE4A | |
| SCHEMBL10629208 | 0.92 | TSHR (0.53) | TSHRTP53HTTCYP2C9PDE4A | |
| Cadaverine Tartrate SCHEMBL8046839 | 0.89 | TSHR (0.50) | TSHRTP53HTTCYP2C9PDE4A | |
| Butanedione SCHEMBL52101 | 0.89 | TSHR (0.50) | TSHRTP53HTTCYP2C9PDE4A |
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-115190815-B | Arylcyclohexylamine derivatives and their use in the treatment of psychotic disorders | 吉尔伽美什制药公司 | 2024-06-18 | — | — | CN | disclosed |