Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | KLK7 | P49862 | 1/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | UCHL1 | P09936 | 6/20 | 0.39 |
| ▸ | HRH2 | P25021 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | TLR2 | O60603 | 1/20 | 0.37 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL18462759 | 0.96 | NPC1 (0.46) | NPC1KLK7ROCK2EPHX2LMNA | |
| SCHEMBL2706099 | 0.96 | NPC1 (0.46) | NPC1KLK7ROCK2EPHX2LMNA | |
| SCHEMBL203386 | 0.92 | NPC1 (0.42) | NPC1KLK7ROCK2EPHX2LMNA | |
| SCHEMBL9977156 | 0.92 | NPC1 (0.42) | NPC1KLK7ROCK2EPHX2LMNA | |
| SCHEMBL2708423 | 0.92 | NPC1 (0.42) | NPC1KLK7ROCK2EPHX2LMNA | |
| SCHEMBL15368132 | 0.92 | NPC1 (0.42) | NPC1KLK7ROCK2EPHX2LMNA | |
| SCHEMBL204193 | 0.91 | USP30 (0.42) | NPC1KLK7ROCK2EPHX2LMNA | |
| SCHEMBL2706884 | 0.91 | USP30 (0.42) | NPC1KLK7ROCK2EPHX2LMNA | |
| SCHEMBL204979 | 0.89 | NPC1 (0.43) | NPC1KLK7ROCK2EPHX2LMNA | |
| SCHEMBL2707870 | 0.89 | NPC1 (0.43) | NPC1KLK7ROCK2EPHX2LMNA |
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-3002281-A1 | ANTIVIRAL COMPOUNDS | Gilead Pharmasset LLC (US) | 2016-04-06 | — | — | EP | disclosed |