Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.47 |
| ▸ | HSD17B1 | P14061 | 3/20 | 0.41 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 6/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 6/20 | 0.39 |
| ▸ | MGLL | Q99685 | 1/20 | 0.38 |
| ▸ | ANPEP | P15144 | 1/20 | 0.38 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.37 |
| ▸ | APP | P05067 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5156636 | 0.79 | CYP2C19 (0.80) | CYP2C19LMNAPTGS2CYP3A4 | |
| SCHEMBL1679382 | 0.78 | CYP2C19 (0.44) | CYP2C19KDM4ELMNAHSD17B10CYP17A1 | |
| SCHEMBL960592 | 0.78 | CYP2C19 (0.71) | CYP2C19PTGS2 | |
| SCHEMBL4265668 | 0.78 | CYP2C19 (0.71) | CYP2C19PTGS2 | |
| SCHEMBL17080041 | 0.77 | CYP2C19 (0.60) | CYP2C19 | |
| SCHEMBL1679476 | 0.76 | CYP2C19 (0.59) | CYP2C19LMNAPTGS2CYP3A4APP | |
| SCHEMBL11077670 | 0.76 | CYP2C19 (0.73) | CYP2C19LMNAHSD17B10PTGS2CYP3A4 | |
| SCHEMBL5879152 | 0.76 | CYP2C19 (0.73) | CYP2C19LMNAPTGS2 | |
| SCHEMBL12497309 | 0.73 | CYP2C19 (0.55) | CYP2C19KDM4ECYP3A4APP | |
| SCHEMBL908748 | 0.73 | CYP2C19 (0.59) | CYP2C19LMNAPTGS2ANPEPCYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| US-7923573-B2 | Benzene compound having 2 or more substituents | DAIICHI SANKYO COMPANY, LIMITED (JP) | 2011-04-12 | — | — | US | disclosed |