Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 10/20 | 0.58 |
| ▸ | BACE1 | P56817 | 9/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.56 |
| ▸ | BCHE | P06276 | 4/20 | 0.53 |
| ▸ | CCR3 | P51677 | 1/20 | 0.53 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.50 |
| ▸ | DRD2 | P14416 | 1/20 | 0.50 |
| ▸ | DRD4 | P21917 | 1/20 | 0.50 |
| ▸ | DRD3 | P35462 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL14636486 | 1.00 | ACHE (0.58) | ACHEBACE1HSD17B10BCHECCR3 | |
| SCHEMBL17590415 | 0.83 | ACHE (0.57) | ACHEBACE1HSD17B10BCHECCR3 | |
| SCHEMBL3366239 | 0.80 | ACHE (0.67) | ACHEBACE1BCHECCR3SIGMAR1 | |
| SCHEMBL14636475 | 0.79 | ACHE (0.52) | ACHEBACE1HSD17B10SIGMAR1L3MBTL1 | |
| SCHEMBL6747485 | 0.77 | RECQL (0.51) | ACHEBACE1HSD17B10BCHEL3MBTL1 | |
| SCHEMBL41919 | 0.77 | ACHE (0.62) | ACHEBACE1BCHECCR3SIGMAR1 | |
| SCHEMBL5091801 | 0.77 | ACHE (0.62) | ACHEBACE1BCHECCR3SIGMAR1 | |
| SCHEMBL7947941 | 0.77 | BACE1 (0.62) | ACHEBACE1BCHE | |
| SCHEMBL7947940 | 0.77 | BACE1 (0.62) | ACHEBACE1BCHE | |
| SCHEMBL14636305 | 0.76 | ACHE (0.48) | ACHEBACE1HSD17B10SIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013010453-A1 | CHEMOKING RECEPTOR ANTAGONISTS | ABBOTT LABORATORIES (US) | 2013-01-24 | — | — | WO | disclosed |