Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 1/20 | 0.37 |
| ▸ | PTGES2 | Q9H7Z7 | 3/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 2/20 | 0.35 |
| ▸ | CA13 | Q8N1Q1 | 2/20 | 0.35 |
| ▸ | MET | P08581 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | EPHB4 | P54760 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.35 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.35 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL790083 | 0.73 | PTGS2 (0.51) | CA1CA2CA9CA13MEN1 | |
| SCHEMBL791121 | 0.72 | PTGDR2 (0.46) | MEN1KMT2ANPC1RAB9AMAP4K4 | |
| SCHEMBL807030 | 0.68 | MEN1 (0.39) | CA1CA2CA9METMEN1 | |
| SCHEMBL807329 | 0.64 | SCN10A (0.48) | MEN1KMT2ANPC1RAB9APIK3CA | |
| SCHEMBL789573 | 0.64 | CDC7 (0.40) | MEN1KMT2AMAPTKDM4EALDH1A1 | |
| SCHEMBL807047 | 0.64 | LRRK2 (0.44) | PIK3CABACE1MAP4K4 | |
| SCHEMBL790542 | 0.64 | SRC (0.49) | MEN1KMT2ANPC1RAB9ALMNA | |
| SCHEMBL18227141 | 0.63 | BACE1 (0.46) | MEN1KMT2ANPC1RAB9ALMNA | |
| SCHEMBL6069536 | 0.63 | EPHB4 (0.54) | EPHB4PIK3CAKDRMAP4K4 | |
| SCHEMBL18227076 | 0.62 | DHFR (0.49) | DHFRMEN1KMT2ANPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012037108-A1 | AMINOQUINOLINE DERIVATIVES AS ANTIVIRAL AGENTS | GLAXOSMITHKLINE LLC (US) | 2012-03-22 | — | — | WO | disclosed |