Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2B | P41595 | 5/20 | 0.47 |
| ▸ | HRH1 | P35367 | 3/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.47 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.47 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.47 |
| ▸ | HTR1A | P08908 | 1/20 | 0.47 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.47 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.47 |
| ▸ | DRD2 | P14416 | 1/20 | 0.47 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.47 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.47 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.47 |
| ▸ | DRD1 | P21728 | 1/20 | 0.47 |
| ▸ | DRD4 | P21917 | 1/20 | 0.47 |
| ▸ | DRD5 | P21918 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | HRH2 | P25021 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL995811 | 0.85 | HTR2B (0.46) | HTR2BHRH1KCNH2ALDH1A1CHRM2 | |
| SCHEMBL995810 | 0.85 | HTR2B (0.46) | HTR2BHRH1KCNH2ALDH1A1CHRM2 | |
| SCHEMBL7206976 | 0.85 | HTR2B (0.46) | HTR2BHRH1KCNH2ALDH1A1CHRM2 | |
| SCHEMBL10048820 | 0.76 | HTR2B (0.72) | HTR2BHRH1KCNH2ALDH1A1CHRM2 | |
| SCHEMBL11760554 | 0.74 | MAOB (0.45) | ALDH1A1MEN1LMNATSHRKMT2A | |
| SCHEMBL18895923 | 0.74 | CCR1 (0.45) | HTR2BHRH1KCNH2ALDH1A1CHRM2 | |
| SCHEMBL10013579 | 0.73 | MAPK14 (0.47) | HTR2BHRH1KCNH2CHRM2SLC22A1 | |
| SCHEMBL7206966 | 0.72 | HTR2B (0.46) | HTR2BHRH1KCNH2ALDH1A1CHRM2 | |
| SCHEMBL7206969 | 0.72 | HTR2B (0.46) | HTR2BHRH1KCNH2ALDH1A1CHRM2 | |
| SCHEMBL14313466 | 0.72 | GAA (0.39) | ALDH1A1MEN1CYP1A2KMT2AKDM4E |
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 |