Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.45 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.41 |
| ▸ | BACE1 | P56817 | 4/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | PREP | P48147 | 2/20 | 0.38 |
| ▸ | CELA1 | Q9UNI1 | 1/20 | 0.38 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.35 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.34 |
| ▸ | SNCA | P37840 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.33 |
| ▸ | ELANE | P08246 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8515697 | 0.84 | BACE1 (0.57) | POLBBACE1ADORA3HPGDELANE | |
| SCHEMBL27877483 | 0.69 | SLC6A4 (0.53) | BACE1SLC6A4SLC6A3ADORA3HPGD | |
| SCHEMBL5764049 | 0.69 | BACE1 (0.54) | ABCB11BACE1SLC6A4SLC6A3HPGD | |
| SCHEMBL8080599 | 0.69 | KDM4E (0.41) | POLBNLRP3ABCB11BACE1PREP | |
| SCHEMBL29172384 | 0.69 | HSD17B10 (0.63) | POLBBACE1HPGDELANEHSD17B10 | |
| SCHEMBL318040 | 0.68 | TSHR (0.45) | ABCB11HSD17B10 | |
| SCHEMBL28540877 | 0.68 | CYP4F2 (0.40) | POLBNLRP3ABCB11BACE1PREP | |
| SCHEMBL10717011 | 0.68 | POLB (0.40) | POLBNLRP3ABCB11BACE1PREP | |
| SCHEMBL19047101 | 0.68 | KDM4E (0.48) | POLBBACE1PREPCELA1HPGD | |
| SCHEMBL27865221 | 0.67 | ABCB11 (0.45) | POLBNLRP3ABCB11BACE1PREP |
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-4107329-A | Fluorinated compounds as therapeutics | IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) | 1978-08-15 | — | — | US | disclosed |