Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB4 | P30926 | 4/20 | 0.49 |
| ▸ | CHRNA3 | P32297 | 4/20 | 0.49 |
| ▸ | CAPN9 | O14815 | 1/20 | 0.44 |
| ▸ | CASP3 | P42574 | 1/20 | 0.44 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.43 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | GAPDH | P04406 | 1/20 | 0.40 |
| ▸ | HSPA1A | P0DMV8 | 1/20 | 0.40 |
| ▸ | HSPA8 | P11142 | 1/20 | 0.40 |
| ▸ | CD44 | P16070 | 1/20 | 0.40 |
| ▸ | MSN | P26038 | 1/20 | 0.40 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.40 |
| ▸ | EZH2 | Q15910 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | SNCA | P37840 | 1/20 | 0.40 |
| ▸ | USP7 | Q93009 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27492634 | 0.87 | CHRNB4 (0.49) | CHRNB4CHRNA3CAPN9CASP3CHRNB2 | |
| SCHEMBL9942558 | 0.81 | CHRNB4 (0.49) | CHRNB4CHRNA3CAPN9CASP3CHRNB2 | |
| SCHEMBL27596768 | 0.81 | CHRNB4 (0.49) | CHRNB4CHRNA3CAPN9CASP3CHRNB2 | |
| SCHEMBL12813209 | 0.81 | CHRNB4 (0.49) | CHRNB4CHRNA3CAPN9CASP3CHRNB2 | |
| SCHEMBL28799453 | 0.78 | CHRNB4 (0.47) | CHRNB4CHRNA3CAPN9CASP3CHRNB2 | |
| SCHEMBL13362026 | 0.77 | CHRNB4 (0.46) | CHRNB4CHRNA3CHRNB2CHRNA4HSP90AA1 | |
| SCHEMBL8113614 | 0.77 | GAPDH (0.52) | CHRNB4CHRNA3CHRNB2CHRNA4HSP90AA1 | |
| SCHEMBL27654661 | 0.77 | NPSR1 (0.46) | CHRNB4CHRNA3CAPN9CASP3CHRNB2 | |
| SCHEMBL27910587 | 0.77 | CHRNB4 (0.46) | CHRNB4CHRNA3CHRNB2CHRNA4HSP90AA1 | |
| SCHEMBL27821121 | 0.77 | CHRNB4 (0.46) | CHRNB4CHRNA3CHRNB2CHRNA4HSP90AA1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104073045-B | Halogeno indole and derivant thereof are as the application of marine antifoulant | 中国科学院烟台海岸带研究所 | 2016-12-28 | — | — | CN | disclosed |
| CN-101605758-A | Methods of treating hepatitis C | PTC THERAPEUTICS INC (US) | 2009-12-16 | — | — | CN | disclosed |
| CN-101541748-A | Methods for treating hepatitis C | PTC THERAPEUTICS INC (US) | 2009-09-23 | — | — | CN | disclosed |
| CN-101027051-A | Methods for treating hepatitis C | PTC THERAPEUTICS INC (US) | 2007-08-29 | — | — | CN | disclosed |
| CN-1764651-A | Quinazoline derivatives as antitumor agents | ASTRAZENECA AB (SE) | 2006-04-26 | — | — | CN | disclosed |