Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | PNPLA2 | Q96AD5 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | STAT1 | P42224 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | RELA | Q04206 | 1/20 | 0.45 |
| ▸ | GBA1 | P04062 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL12270039 | 0.83 | KMT2A (0.61) | MAPTMEN1NPC1NFKB1STAT1 | |
| SCHEMBL13680585 | 0.82 | KIF11 (0.56) | MAPTMEN1NPC1NFKB1STAT1 | |
| SCHEMBL13537053 | 0.81 | SMN1; SMN2 (0.49) | TSHRMAPTMEN1NPC1NFKB1 | |
| SCHEMBL13680553 | 0.81 | GBA1 (0.52) | TSHRMAPTMEN1NPC1NFKB1 | |
| SCHEMBL11686928 | 0.77 | SMN1; SMN2 (0.48) | TSHRMAPTMEN1NPC1RAB9A | |
| SCHEMBL13680473 | 0.77 | TGFBR1 (0.48) | TSHRMEN1KMT2ATP53SMN1; SMN2 | |
| SCHEMBL13680841 | 0.77 | TSHR (0.40) | TSHRPNPLA2HDAC6MEN1KMT2A | |
| SCHEMBL13680672 | 0.76 | CYP1A2 (0.46) | TSHRMAPTMEN1NPC1NFKB1 | |
| SCHEMBL3422361 | 0.75 | CCR1 (0.75) | MAPTMEN1RAB9AKMT2A | |
| SCHEMBL687878 | 0.75 | TSHR (0.79) | TSHRMEN1KMT2ACA12CA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7582658-B2 | Bicyclic compound | ASAHI KASEI PHARMA CORPORATION (JP) | 2009-09-01 | — | — | US | disclosed |
| US-7582658-B2 | Bicyclic compound | ASAHI KASEI PHARMA CORPORATION (JP) | 2009-09-01 | — | — | US | disclosed |