Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 6/20 | 0.41 |
| ▸ | PGR | P06401 | 3/20 | 0.41 |
| ▸ | PPARG | P37231 | 2/20 | 0.41 |
| ▸ | ESR1 | P03372 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 7/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | ALB | P02768 | 1/20 | 0.37 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.37 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.37 |
| ▸ | SLC22A11 | Q9NSA0 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | FAP | Q12884 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9363531 | 1.00 | NR1I2 (0.41) | NR1I2PGRPPARGESR1TDP1 | |
| SCHEMBL8443059 | 1.00 | NR1I2 (0.41) | NR1I2PGRPPARGESR1TDP1 | |
| SCHEMBL8444999 | 0.93 | NR1I2 (0.46) | NR1I2PGRPPARGESR1TDP1 | |
| SCHEMBL8444995 | 0.93 | NR1I2 (0.46) | NR1I2PGRPPARGESR1TDP1 | |
| SCHEMBL5674214 | 0.91 | PTGS1 (0.47) | NR1I2PGRPPARGESR1TDP1 | |
| SCHEMBL5674212 | 0.91 | PTGS1 (0.47) | NR1I2PGRPPARGESR1TDP1 | |
| SCHEMBL7643449 | 0.91 | NR1I2 (0.41) | NR1I2PGRPPARGESR1TDP1 | |
| SCHEMBL9698798 | 0.91 | NR1I2 (0.42) | NR1I2PGRPPARGESR1TDP1 | |
| SCHEMBL7643450 | 0.91 | NR1I2 (0.41) | NR1I2PGRPPARGESR1TDP1 | |
| SCHEMBL9363019 | 0.91 | NR1I2 (0.42) | NR1I2PGRPPARGESR1TDP1 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0594263-B1 | INTERMEDIATES FOR THE PREPARATION OF THIOALKYLTHIO CEPHALOSPORIN DERIVATIVES | SHIONOGI & CO (JP) | 1999-06-09 | — | — | EP | disclosed |
| EP-0581552-B1 | Triazolylthiomethylthio cephalosporin hyrochloride, its crystalline hydrate and the production of the same | SHIONOGI & CO (JP) | 1998-04-22 | — | — | EP | disclosed |
| US-5407929-A | Triazolylthiomethylthio cephalosporin hydrochhloride, its crystalline hydrate and the production of the same | SHIONOGI & CO., LTD. (JP) | 1995-04-18 | — | — | US | disclosed |
| US-5352792-A | Bactericides | SHIONOGI & CO., LTD. (JP) | 1994-10-04 | — | — | US | disclosed |
| EP-0467647-B1 | Thioalkylthio cephalosporin derivatives | SHIONOGI & CO (JP) | 1994-08-17 | — | — | EP | disclosed |
| EP-0594263-A1 | Thioalkylthio cephalosporin derivatives and intermediates | SHIONOGI SEIYAKU KABUSHIKI KAISHA trading under the name of SHIONOGI & CO. LTD. (JP) | 1994-04-27 | — | — | EP | disclosed |
| US-5214037-A | Antibiotic, bactericide | SHIONOGI & CO., LTD. (JP) | 1993-05-25 | — | — | US | disclosed |
| EP-0467647-A2 | Thioalkylthio cephalosporin derivatives | SHIONOGI SEIYAKU KABUSHIKI KAISHA trading under the name of SHIONOGI & CO. LTD. (JP) | 1992-01-22 | — | — | EP | disclosed |