Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 5/20 | 0.51 |
| ▸ | AAK1 | Q2M2I8 | 5/20 | 0.47 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.46 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.46 |
| ▸ | NOS3 | P29474 | 5/20 | 0.45 |
| ▸ | NOS2 | P35228 | 5/20 | 0.45 |
| ▸ | NOS1 | P29475 | 4/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.45 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.45 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.45 |
| ▸ | CIT | O14578 | 1/20 | 0.43 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.42 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | LARS1 | Q9P2J5 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4402187 | 0.81 | DYRK1A (0.63) | DYRK1AAAK1MKNK1MKNK2NOS3 | |
| SCHEMBL30935767 | 0.81 | DYRK1A (0.63) | DYRK1AAAK1MKNK1MKNK2NOS3 | |
| SCHEMBL14063540 | 0.80 | MAP4K4 (0.49) | MKNK1MKNK2MEN1 | |
| SCHEMBL17773153 | 0.80 | MAPT (0.46) | DYRK1AAAK1GSK3B | |
| Hydrochloric Acid SCHEMBL10461111 | 0.79 | DYRK1A (0.61) | DYRK1AAAK1MKNK1MKNK2NOS3 | |
| SCHEMBL2737364 | 0.78 | PLAU (0.43) | — | |
| SCHEMBL30337203 | 0.77 | DYRK1A (0.70) | DYRK1AAAK1MKNK1MKNK2NOS3 | |
| SCHEMBL25100682 | 0.77 | DYRK1A (0.47) | DYRK1AAAK1MKNK1MKNK2NOS3 | |
| SCHEMBL27569396 | 0.76 | DYRK1A (0.41) | DYRK1AAAK1MKNK1MKNK2NOS3 | |
| SCHEMBL17341047 | 0.76 | MAPK10 (0.43) | — |
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-7429604-B2 | Six-membered heterocycles useful as serine protease inhibitors | BRISTOL MYERS SQUIBB COMPANY (US) | 2008-09-30 | — | — | US | disclosed |