Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.53 |
| ▸ | LOXL2 | Q9Y4K0 | 4/20 | 0.48 |
| ▸ | LOX | P28300 | 2/20 | 0.47 |
| ▸ | TLR4 | O00206 | 1/20 | 0.45 |
| ▸ | TLR2 | O60603 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.43 |
| ▸ | MGLL | Q99685 | 1/20 | 0.43 |
| ▸ | GRM5 | P41594 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.42 |
| ▸ | HRH1 | P35367 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3294752 | 0.88 | LOXL2 (0.62) | LOXL2LOXTLR4TLR2MAP4K4 | |
| SCHEMBL6199971 | 0.83 | TAAR1 (0.62) | TAAR1ACHEMAOB | |
| SCHEMBL6203524 | 0.82 | TAAR1 (0.50) | TAAR1LOXL2LOXACHEMAOB | |
| SCHEMBL1747080 | 0.81 | MGLL (0.47) | LOXL2LOXTLR4TLR2MAP4K4 | |
| SCHEMBL5024643 | 0.81 | TLR4 (0.47) | LOXL2LOXTLR4TLR2MAP4K4 | |
| SCHEMBL27233574 | 0.81 | TLR4 (0.47) | LOXL2LOXTLR4TLR2MAP4K4 | |
| SCHEMBL9048874 | 0.81 | TLR4 (0.45) | LOXL2LOXTLR4TLR2MAP4K4 | |
| SCHEMBL29612417 | 0.80 | TLR4 (0.56) | LOXL2LOXTLR4TLR2MAP4K4 | |
| SCHEMBL12129555 | 0.80 | TLR4 (0.56) | LOXL2LOXTLR4TLR2MAP4K4 | |
| SCHEMBL4389700 | 0.79 | TLR4 (0.55) | LOXL2TLR4TLR2MAP4K4MGLL |
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-1581498-A2 | PYRIDINYL, PYRIMIDINYL AND PYRAZINYL AMIDES AS POTASSIUM CHANNEL OPENERS | Bristol-Myers Squibb Company (US) | 2005-10-05 | — | — | EP | disclosed |
| WO-2004047739-A2 | PYRIDINYL, PYRIMIDINYL AND PYRAZINYL AMIDES AS POTASSIUM CHANNEL OPENERS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2004-06-10 | — | — | WO | disclosed |