Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 6/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.48 |
| ▸ | CYP2E1 | P05181 | 3/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.48 |
| ▸ | CYP2B6 | P20813 | 3/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 4/20 | 0.40 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.40 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.34 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.34 |
| ▸ | FYN | P06241 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL15471025 | 0.73 | CYP2A6 (0.69) | CYP2A6CYP2C19CYP3A4CYP2E1CYP2C9 | |
| SCHEMBL4869247 | 0.72 | CYP2A6 (0.59) | CYP2A6CYP2C19CYP3A4CYP2E1CYP2C9 | |
| SCHEMBL5507651 | 0.72 | CYP2A6 (0.56) | CYP2A6CYP2C19CYP3A4CYP2E1CYP2C9 | |
| SCHEMBL4864745 | 0.71 | CYP2A6 (0.52) | CYP2A6CYP2C19CYP3A4CYP2E1CYP2C9 | |
| SCHEMBL4870330 | 0.71 | CYP2A6 (0.52) | CYP2A6CYP2C19CYP3A4CYP2E1CYP2C9 | |
| SCHEMBL4862008 | 0.71 | CYP2A6 (0.54) | CYP2A6CYP2C19CYP3A4CYP2E1CYP2C9 | |
| SCHEMBL4870983 | 0.70 | CYP2A6 (0.48) | CYP2A6CYP2C19CYP3A4CYP2E1CYP2C9 | |
| SCHEMBL13527034 | 0.70 | CYP2A6 (0.64) | CYP2A6CYP2C19CYP3A4CYP2E1CYP2C9 | |
| SCHEMBL17688341 | 0.67 | CYP2A6 (0.55) | CYP2A6CYP2C19CYP3A4CYP2E1CYP2C9 | |
| SCHEMBL24809712 | 0.67 | CYP2A6 (0.49) | CYP2A6CYP2C19CYP3A4CYP2E1CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| US-6403776-B1 | TREATING ANTIBIOTIC COMPOUND WITH NUCLEOPHILE TO CLEAVE PROTECTING GROUP FROM HYDROXYL GROUP | PFIZER INC. | 2002-06-11 | — | — | US | disclosed |
| EP-1088828-A2 | Synthesis of carbamate ketolide antibiotics | Pfizer Products Inc. (US) | 2001-04-04 | — | — | EP | disclosed |