Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
| ▸ | TRPC3 | Q13507 | 1/20 | 0.32 |
| ▸ | TRPC7 | Q9HCX4 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.32 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.32 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | IDH1 | O75874 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.30 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | PSD | A5PKW4 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL15993481 | 1.00 | CYP3A4 (0.39) | CYP3A4PPARATRPC3TRPC7KDM4E | |
| SCHEMBL14972088 | 1.00 | CYP3A4 (0.39) | CYP3A4PPARATRPC3TRPC7KDM4E | |
| SCHEMBL14971945 | 1.00 | CYP3A4 (0.39) | CYP3A4PPARATRPC3TRPC7KDM4E | |
| SCHEMBL14971932 | 0.93 | CYP3A4 (0.39) | CYP3A4PPARATRPC3TRPC7KDM4E | |
| SCHEMBL15992934 | 0.93 | CYP3A4 (0.39) | CYP3A4PPARATRPC3TRPC7KDM4E | |
| SCHEMBL14971774 | 0.93 | CYP3A4 (0.39) | CYP3A4PPARATRPC3TRPC7KDM4E | |
| SCHEMBL15993120 | 0.92 | CYP3A4 (0.39) | CYP3A4PPARATRPC3TRPC7KDM4E | |
| SCHEMBL15993682 | 0.92 | CYP3A4 (0.39) | CYP3A4PPARATRPC3TRPC7KDM4E | |
| SCHEMBL14971787 | 0.92 | CYP3A4 (0.39) | CYP3A4PPARATRPC3TRPC7KDM4E | |
| SCHEMBL14971818 | 0.92 | CYP3A4 (0.36) | CYP3A4PPARATRPC3TRPC7KDM4E |
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-9499537-B2 | Antiviral pyrrolopyridine derivatives and method for preparing the same | KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) | 2016-11-22 | — | — | US | disclosed |