Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 4/20 | 0.44 |
| ▸ | ESR1 | P03372 | 2/20 | 0.44 |
| ▸ | PPARG | P37231 | 2/20 | 0.44 |
| ▸ | PGR | P06401 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 9/20 | 0.44 |
| ▸ | MAPT | P10636 | 5/20 | 0.44 |
| ▸ | APEX1 | P27695 | 4/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | ABCC4 | O15439 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | RECQL | P46063 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8701454 | 1.00 | NR1I2 (0.44) | NR1I2ESR1PPARGPGRTDP1 | |
| SCHEMBL8701461 | 1.00 | NR1I2 (0.44) | NR1I2ESR1PPARGPGRTDP1 | |
| SCHEMBL8702091 | 0.95 | NR1I2 (0.45) | NR1I2ESR1PPARGPGRTDP1 | |
| SCHEMBL8702107 | 0.95 | NR1I2 (0.45) | NR1I2ESR1PPARGPGRTDP1 | |
| SCHEMBL8702083 | 0.95 | NR1I2 (0.45) | NR1I2ESR1PPARGPGRTDP1 | |
| SCHEMBL8702047 | 0.94 | NR1I2 (0.45) | NR1I2ESR1PPARGPGRTDP1 | |
| SCHEMBL8702036 | 0.94 | NR1I2 (0.45) | NR1I2ESR1PPARGPGRTDP1 | |
| SCHEMBL8708101 | 0.94 | NR1I2 (0.44) | NR1I2ESR1PPARGPGRTDP1 | |
| SCHEMBL8708116 | 0.94 | NR1I2 (0.44) | NR1I2ESR1PPARGPGRTDP1 | |
| SCHEMBL8708093 | 0.94 | NR1I2 (0.44) | NR1I2ESR1PPARGPGRTDP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0838465-A1 | Pyridinium-substituted (lactamylvinyl)cephalosporin derivatives, their preparation and their use as antibiotics | F. HOFFMANN-LA ROCHE AG (CH) | 1998-04-29 | — | — | EP | disclosed |