Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 3/20 | 0.37 |
| ▸ | HTR2C | P28335 | 3/20 | 0.37 |
| ▸ | HTR2B | P41595 | 3/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.36 |
| ▸ | CCR5 | P51681 | 7/20 | 0.35 |
| ▸ | DRD4 | P21917 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL1096334 | 0.94 | HTR2A (0.37) | HTR2AHTR2CHTR2BCHRM2CHRM1 | |
| SCHEMBL3572234 | 0.89 | HTR2A (0.39) | HTR2AHTR2CHTR2BCHRM2CHRM1 | |
| SCHEMBL1097191 | 0.84 | CCR5 (0.38) | HTR2AHTR2CHTR2BCHRM2CHRM1 | |
| SCHEMBL3572984 | 0.83 | HTR2A (0.39) | HTR2AHTR2CHTR2BCHRM2CHRM1 | |
| SCHEMBL1096333 | 0.79 | CCR5 (0.36) | HTR2AHTR2CHTR2BCHRM2CHRM1 | |
| SCHEMBL1097156 | 0.76 | CASR (0.42) | CCR5 | |
| SCHEMBL1096396 | 0.74 | ESR1 (0.33) | CHRM2CCR5 | |
| SCHEMBL16274940 | 0.74 | CCR5 (0.44) | CCR5 | |
| SCHEMBL1096778 | 0.74 | CCR5 (0.39) | CCR5 | |
| SCHEMBL1096146 | 0.71 | KCNH2 (0.32) | CCR5 |
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-8153658-B2 | Piperidine derivative or salt thereof | ASTELLAS PHARMA, INC. (JP) | 2012-04-10 | — | — | US | disclosed |