Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 5/20 | 0.49 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.49 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.49 |
| ▸ | HTR1A | P08908 | 3/20 | 0.49 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.49 |
| ▸ | DRD2 | P14416 | 3/20 | 0.49 |
| ▸ | HTR2A | P28223 | 3/20 | 0.49 |
| ▸ | HTR2C | P28335 | 3/20 | 0.49 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.49 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.49 |
| ▸ | HTR2B | P41595 | 3/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.49 |
| ▸ | RET | P07949 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.49 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.49 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.49 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL14313664 | 1.00 | HRH1 (0.49) | HRH1SLC6A2CYP3A4CYP1A2CHRM2 | |
| SCHEMBL18486427 | 0.83 | SLC6A2 (0.67) | HRH1SLC6A2CYP3A4CYP1A2CHRM2 | |
| SCHEMBL31317931 | 0.78 | HRH1 (0.58) | HRH1CHRM2HTR1ACHRM1DRD2 | |
| SCHEMBL730635 | 0.78 | HRH1 (0.58) | HRH1CHRM2HTR1ACHRM1DRD2 | |
| SCHEMBL4155420 | 0.77 | HRH1 (0.49) | HRH1SLC6A2CYP3A4CYP1A2CHRM2 | |
| SCHEMBL4155423 | 0.77 | HRH1 (0.49) | HRH1SLC6A2CYP3A4CYP1A2CHRM2 | |
| SCHEMBL17368835 | 0.74 | PTAFR (0.46) | HRH1SLC6A2CYP3A4CHRM2HTR1A | |
| SCHEMBL8936293 | 0.73 | CYP3A4 (0.49) | HRH1SLC6A2CYP3A4CYP1A2CHRM2 | |
| SCHEMBL28722279 | 0.71 | TSHR (0.52) | HRH1CHRM2HTR1ACHRM1DRD2 | |
| SCHEMBL3900928 | 0.71 | NPY5R (0.53) | HRH1CHRM2HTR1ACHRM1DRD2 |
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-7320993-B1 | Aryl-substituted pyridylalkane, alkene, and alkine carboxamides useful as cytostatic useful as cytostatic and immuosuppressive agents | ASTELLAS DEUTSCHLAND GMBH (DE) | 2008-01-22 | — | — | US | disclosed |