Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLA | P06280 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.43 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.43 |
| ▸ | CYP24A1 | Q07973 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7491561 | 0.82 | ALDH1A1 (0.47) | MEN1KMT2ACYP3A4MAPTSMN1; SMN2 | |
| SCHEMBL5200672 | 0.82 | RECQL (0.44) | MEN1KMT2ATSHRSMN1; SMN2 | |
| SCHEMBL30288224 | 0.81 | CYP3A4 (0.54) | MEN1KMT2ACYP3A4MAPTSMN1; SMN2 | |
| SCHEMBL874390 | 0.79 | GLA (0.48) | GLANPSR1POLBTLR9CYP26A1 | |
| SCHEMBL9026480 | 0.79 | CYP26A1 (0.47) | CYP26A1CYP24A1CYP3A4 | |
| SCHEMBL3685687 | 0.78 | MAOB (0.49) | — | |
| SCHEMBL7906013 | 0.78 | MAOB (0.49) | — | |
| SCHEMBL7899581 | 0.78 | MAOB (0.49) | — | |
| SCHEMBL28521700 | 0.77 | SHBG (0.62) | GLAMEN1KMT2ATSHRCYP3A4 | |
| SCHEMBL31708239 | 0.76 | ALDH1A1 (0.36) | — |
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-117586284-A | Macrocyclic compound, and preparation method and application thereof | 深圳信立泰药业股份有限公司 | 2024-02-23 | — | — | CN | disclosed |
| EP-0562185-A1 | 3-(Arylmethyl)-1-(3'-diethylaminopropyl) pyrrolidines and process of preparation thereof | Council of Scientific and Industrial Research (IN) | 1993-09-29 | — | — | EP | disclosed |