Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 6/20 | 0.43 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.43 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.43 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | HTR1A | P08908 | 2/20 | 0.41 |
| ▸ | HTR6 | P50406 | 2/20 | 0.41 |
| ▸ | HTR2C | P28335 | 3/20 | 0.40 |
| ▸ | HTR2B | P41595 | 2/20 | 0.40 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.40 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.40 |
| ▸ | SPR | P35270 | 1/20 | 0.39 |
| ▸ | CFTR | P13569 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.38 |
| ▸ | HTR3B | O95264 | 1/20 | 0.38 |
| ▸ | HTR1D | P28221 | 1/20 | 0.38 |
| ▸ | HTR1B | P28222 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL15074675 | 0.82 | HTR2A (0.63) | HTR2ACHRNB2CHRNA7CHRNA4NPC1 | |
| SCHEMBL397322 | 0.81 | HTR2A (0.50) | HTR2ACHRNB2CHRNA7CHRNA4MEN1 | |
| SCHEMBL5497322 | 0.81 | HTR2A (0.50) | HTR2ACHRNB2CHRNA7CHRNA4MEN1 | |
| SCHEMBL11924512 | 0.81 | HTR1A (0.51) | HTR2ACHRNB2CHRNA7CHRNA4NPC1 | |
| SCHEMBL5484718 | 0.80 | CFTR (0.53) | HTR2ACHRNB2CHRNA7CHRNA4NPC1 | |
| SCHEMBL8957544 | 0.79 | HTR1D (0.51) | HTR2ACHRNB2CHRNA7CHRNA4NPC1 | |
| SCHEMBL13651810 | 0.77 | HTR2A (0.58) | HTR2AMEN1KMT2AHTR1AHTR6 | |
| SCHEMBL9001726 | 0.77 | HTR1D (0.40) | HTR2ACHRNB2CHRNA7CHRNA4NPC1 | |
| SCHEMBL398456 | 0.75 | CFTR (0.78) | CFTR | |
| SCHEMBL25082440 | 0.71 | HTR2A (0.68) | HTR2AHTR1AHTR6HTR2CHTR2B |
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 |
|---|---|---|---|---|---|---|---|
| EP-1773816-A2 | MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS | Vertex Pharmaceuticals Incorporated (US) | 2007-04-18 | — | — | EP | disclosed |
| WO-2006002421-A2 | MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2006-01-05 | — | — | WO | disclosed |