Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX3 | P56373 | 1/20 | 0.46 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | P2RY12 | Q9H244 | 7/20 | 0.41 |
| ▸ | NPBWR1 | P48145 | 2/20 | 0.40 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | LIPE | Q05469 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2525360 | 0.80 | PDE4B (0.71) | PDE4B | |
| SCHEMBL8008270 | 0.79 | LMNA (0.54) | POLBLMNABCHELIPEALDH1A1 | |
| SCHEMBL17684268 | 0.79 | P2RX3 (0.52) | P2RX3CYP1A2P2RY12NPBWR1MCHR1 | |
| SCHEMBL14748406 | 0.79 | PDE4B (0.42) | PDE4BCYP1A2LMNAALDH1A1 | |
| SCHEMBL15096440 | 0.76 | L3MBTL1 (0.54) | P2RX3CYP1A2P2RY12NPBWR1MCHR1 | |
| SCHEMBL14748412 | 0.75 | PDE4B (0.41) | PDE4B | |
| SCHEMBL14748429 | 0.74 | PTGS2 (0.43) | PDE4BL3MBTL1MAOBALDH1A1 | |
| SCHEMBL875911 | 0.72 | RAB9A (0.54) | P2RX3CYP1A2P2RY12L3MBTL1MAOB | |
| SCHEMBL14831712 | 0.68 | ALDH1A1 (0.44) | P2RY12L3MBTL1MAOBALDH1A1 | |
| SCHEMBL7862589 | 0.68 | PDE4B (0.42) | PDE4BLIPE |
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-3246034-A1 | BORON-CONTAINING SMALL MOLECULES AS ANTI-INFLAMMATORY AGENTS | Anacor Pharmaceuticals, Inc. (US) | 2017-11-22 | — | — | EP | disclosed |
| EP-2564857-A1 | Boron-containing small molecules as anti-inflammatory agents | Anacor Pharmaceuticals, Inc. (US) | 2013-03-06 | — | — | EP | disclosed |