Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 4/20 | 0.46 |
| ▸ | PPARG | P37231 | 2/20 | 0.46 |
| ▸ | PGR | P06401 | 2/20 | 0.46 |
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 6/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.42 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.42 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | ALB | P02768 | 1/20 | 0.42 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.42 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.42 |
| ▸ | SLC22A11 | Q9NSA0 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10848834 | 1.00 | NR1I2 (0.46) | NR1I2PPARGPGRESR1TDP1 | |
| SCHEMBL10805334 | 0.94 | NR1I2 (0.47) | NR1I2PPARGPGRESR1TDP1 | |
| SCHEMBL9201934 | 0.94 | NR1I2 (0.47) | NR1I2PPARGPGRESR1TDP1 | |
| SCHEMBL5712657 | 0.94 | NR1I2 (0.47) | NR1I2PPARGPGRESR1TDP1 | |
| SCHEMBL5712656 | 0.94 | NR1I2 (0.47) | NR1I2PPARGPGRESR1TDP1 | |
| Iodide SCHEMBL11073275 | 0.92 | NR1I2 (0.45) | NR1I2PPARGPGRESR1TDP1 | |
| SCHEMBL10850349 | 0.91 | PTGS1 (0.48) | NR1I2PPARGPGRESR1TDP1 | |
| SCHEMBL10850361 | 0.91 | PTGS1 (0.48) | NR1I2PPARGPGRESR1TDP1 | |
| SCHEMBL8766306 | 0.91 | NR1I2 (0.44) | NR1I2PPARGPGRESR1TDP1 | |
| SCHEMBL5672538 | 0.91 | PTGS1 (0.52) | NR1I2PPARGPGRESR1TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4622393-A | 3-vinyl-cephalosporins and their preparations | RHONE-POULENC INDUSTRIES (FR) | 1986-11-11 | — | — | US | disclosed |
| US-4423214-A | 3-Vinylcephalosporin derivatives | RHONE-POULENC INDUSTRIES (FR) | 1983-12-27 | — | — | US | disclosed |
| US-4415562-A | 3-Thiovinylcephalosporins and pharmaceutical compositions | RHONE-POULENC INDUSTRIES (FR) | 1983-11-15 | — | — | US | disclosed |