Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 6/20 | 0.44 |
| ▸ | RAB9A | P51151 | 4/20 | 0.37 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 4/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | PDE4A | P27815 | 2/20 | 0.34 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.34 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14748463 | 0.88 | PDE4B (0.47) | PDE4BRAB9ANPC1HSD17B10TP53 | |
| SCHEMBL14748461 | 0.85 | TBXA2R (0.36) | PDE4BARMAPTPDE4APDE4C | |
| SCHEMBL8007244 | 0.84 | PDE4B (0.42) | PDE4BRAB9ANPC1HSD17B10TP53 | |
| SCHEMBL19622210 | 0.83 | PDE4B (0.44) | PDE4BRAB9ANPC1HSD17B10TP53 | |
| SCHEMBL2531250 | 0.80 | PDE4B (0.68) | PDE4BPDE4APDE4CPDE4D | |
| SCHEMBL14748447 | 0.79 | HPGD (0.42) | PDE4BHSD17B10TP53HPGDPOLB | |
| SCHEMBL14748366 | 0.79 | PDE4B (0.42) | PDE4BARPDE4APDE4CPDE4D | |
| SCHEMBL19622201 | 0.79 | PDE4B (0.48) | PDE4BARPOLBPDE4APDE4C | |
| SCHEMBL19622212 | 0.78 | PDE4B (0.53) | PDE4BPDE4APDE4CPDE4D | |
| SCHEMBL13515779 | 0.77 | NPC1 (0.58) | RAB9ANPC1HSD17B10TP53AR |
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 |
|---|---|---|---|---|---|---|---|
| EP-2564857-A1 | Boron-containing small molecules as anti-inflammatory agents | Anacor Pharmaceuticals, Inc. (US) | 2013-03-06 | — | — | EP | disclosed |