Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 6/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | HRH1 | P35367 | 1/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
| ▸ | HTR6 | P50406 | 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 | |
|---|---|---|---|---|
| SCHEMBL11445213 | 0.89 | CYP2D6 (0.51) | CHRNA7TAAR1HRH3CYP2D6HRH1 | |
| SCHEMBL2491068 | 0.80 | HRH1 (0.50) | CHRNA7HRH3CYP2D6HRH1CHRNB2 | |
| SCHEMBL16327094 | 0.78 | NPSR1 (0.41) | CHRNA7TAAR1HRH3CYP2D6HRH1 | |
| SCHEMBL1241260 | 0.77 | TAAR1 (0.52) | CHRNA7TAAR1HRH3CYP2D6HRH1 | |
| SCHEMBL19566680 | 0.77 | CHRNA7 (0.38) | CHRNA7TAAR1HRH3CYP2D6HRH1 | |
| SCHEMBL9053685 | 0.75 | TAAR1 (0.38) | CHRNA7TAAR1HRH3HRH4 | |
| SCHEMBL10811899 | 0.74 | CHRNA7 (0.36) | CHRNA7TAAR1HRH3CYP2D6HRH1 | |
| SCHEMBL19564551 | 0.74 | HRH3 (0.38) | CHRNA7TAAR1HRH3CYP2D6HRH1 | |
| SCHEMBL17841653 | 0.72 | CXCR2 (0.40) | CHRNA7TAAR1HRH3CYP2D6HRH1 | |
| SCHEMBL229256 | 0.70 | KDM4E (0.58) | TAAR1HRH3CYP2D6HRH1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1996000248-A1 | WATER MISCIBLE NON-HYDROLYZABLE CROSS-LINKERS AND HIGH REFRACTIVE INDEX HYDROGELS PREPARED THEREWITH | KABI PHARMACIA OPHTHALMICS, INC. (US) | 1996-01-04 | — | — | WO | claimed |
| US-5439950-A | Intraocular lenses | KABI PHARMACIA OPHTHALMICS, INC. (US) | 1995-08-08 | — | — | US | disclosed |