Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRSS1 | P07477 | 2/20 | 0.41 |
| ▸ | CTRC | Q99895 | 2/20 | 0.41 |
| ▸ | F2 | P00734 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.35 |
| ▸ | ELANE | P08246 | 1/20 | 0.34 |
| ▸ | CTSG | P08311 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | SLC6A1 | P30531 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | SHBG | P04278 | 1/20 | 0.31 |
| ▸ | FAAH | O00519 | 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 | |
|---|---|---|---|---|
| SCHEMBL6427222 | 1.00 | PRSS1 (0.41) | PRSS1CTRCF2CYP19A1ELANE | |
| SCHEMBL6295869 | 1.00 | PRSS1 (0.41) | PRSS1CTRCF2CYP19A1ELANE | |
| SCHEMBL6427227 | 1.00 | PRSS1 (0.41) | PRSS1CTRCF2CYP19A1ELANE | |
| SCHEMBL9616924 | 0.81 | F2 (0.42) | PRSS1CTRCF2ELANECTSG | |
| SCHEMBL2845072 | 0.80 | PRSS1 (0.38) | PRSS1CTRCF2CYP19A1ELANE | |
| SCHEMBL14601491 | 0.79 | PRSS1 (0.37) | PRSS1CTRCF2ELANECTSG | |
| SCHEMBL14149503 | 0.74 | — | — | |
| SCHEMBL14113498 | 0.74 | — | — | |
| SCHEMBL16318869 | 0.74 | — | — | |
| SCHEMBL18239488 | 0.73 | MEN1 (0.36) | PRSS1CTRCF2CYP19A1MEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1048662-B1 | NOVEL PROCESS FOR PRODUCING 3-HYDROXY-GAMMA-BUTYROLACTONE DERIVATIVES | DAISO CO LTD (JP) | 2003-04-23 | — | — | EP | disclosed |
| US-6268515-B1 | REACTING 3-HYDROXY-.GAMMA.-BUTYOLACTONE WITH A METAL SALT OF HEXAMETHYLDISILAZANE, AND THEN REACTING IT WITH AN ELECTROPHILIC REAGENT | DAISO CO., LTD. (JP) | 2001-07-31 | — | — | US | disclosed |
| EP-1048662-A1 | NOVEL PROCESS FOR PRODUCING 3-HYDROXY-GAMMA-BUTYROLACTONE DERIVATIVES | DAISO CO., LTD. (JP) | 2000-11-02 | — | — | EP | disclosed |