Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 13/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2068537 | 0.78 | KCNH2 (1.00) | KCNH2CYP3A4PTGDR2P2RX7 | |
| SCHEMBL1052384 | 0.76 | KCNH2 (0.82) | KCNH2CYP3A4PTGDR2MAPTP2RX7 | |
| SCHEMBL2067454 | 0.76 | KCNH2 (0.82) | KCNH2CYP3A4PTGDR2MAPTP2RX7 | |
| SCHEMBL2067365 | 0.74 | KCNH2 (0.77) | KCNH2CYP3A4TP53GAAMAPT | |
| SCHEMBL2069967 | 0.74 | KCNH2 (0.74) | KCNH2CYP3A4PTGDR2MAPTP2RX7 | |
| SCHEMBL2068572 | 0.74 | KCNH2 (0.76) | KCNH2CYP3A4PTGDR2P2RX7 | |
| SCHEMBL12952195 | 0.74 | KCNH2 (0.74) | KCNH2CYP3A4PTGDR2MAPTP2RX7 | |
| SCHEMBL20121561 | 0.73 | KCNH2 (0.76) | KCNH2CYP3A4PTGDR2P2RX7 | |
| SCHEMBL20121606 | 0.73 | KCNH2 (0.68) | KCNH2CYP3A4PTGDR2MAPTP2RX7 | |
| SCHEMBL997017 | 0.73 | KCNH2 (0.70) | KCNH2CYP3A4PTGDR2P2RX7 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2451814-A2 | FUSED IMIDAZOLES AND COMPOSITIONS COMPRISING THEM FOR THE TREATMENT OF PARASITIC DISEASES, SUCH AS E.G. MALARIA | IRM LLC (BM) | 2012-05-16 | — | — | EP | claimed |
| WO-2011006143-A2 | COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PARASITIC DISEASES | IRM LLC (BM) | 2011-01-13 | — | — | WO | claimed |