Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 3/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | PLAU | P00749 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | IGF1R | P08069 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8874130 | 0.94 | CYP3A4 (0.47) | NR1I2CYP3A4CYP2D6HDAC6RAB9A | |
| SCHEMBL8138668 | 0.88 | NR1I2 (0.54) | NR1I2CYP3A4CYP2D6RAB9AGAA | |
| SCHEMBL8875424 | 0.86 | NR1I2 (0.47) | NR1I2CYP3A4CYP2D6RAB9AGAA | |
| SCHEMBL8130662 | 0.85 | NR1I2 (0.43) | NR1I2CYP3A4CYP2D6RAB9AGAA | |
| SCHEMBL10413141 | 0.82 | PLAU (0.51) | NR1I2CYP3A4CYP2D6HDAC6RAB9A | |
| SCHEMBL9436198 | 0.81 | LMNA (0.42) | NR1I2CYP3A4CYP2D6HDAC6RAB9A | |
| SCHEMBL14007038 | 0.81 | NR1I2 (0.45) | NR1I2CYP3A4CYP2D6RAB9AGAA | |
| SCHEMBL13623358 | 0.81 | NR1I2 (0.45) | NR1I2CYP3A4CYP2D6RAB9AGAA | |
| SCHEMBL8875258 | 0.79 | NR1I2 (0.44) | NR1I2CYP3A4CYP2D6HDAC6RAB9A | |
| SCHEMBL10413619 | 0.79 | NR1I2 (0.44) | NR1I2CYP3A4CYP2D6HDAC6RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-5643929-A | TREATMENT OF PICORNAVIRAL OR RHINOVIRUS AND CHEMICAL INTERMEDIATES | SANOFI WINTHROP, INC. (US) | 1997-07-01 | — | — | US | disclosed |
| US-5349068-A | 1,2,4-oxadiazolyl-phenoxyalkylisoxazoles and their use as antiviral agents | STERLING WINTHROP INC. (US) | 1994-09-20 | — | — | US | disclosed |