Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 2/20 | 0.40 |
| ▸ | CNR2 | P34972 | 2/20 | 0.40 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.39 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | HRH2 | P25021 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9502127 | 0.98 | PDE5A (0.42) | PDE5AGAAHTTKMT2ANPSR1 | |
| SCHEMBL7755498 | 0.89 | PDE5A (0.42) | PDE5AGAAHTTKMT2ANPSR1 | |
| SCHEMBL4093891 | 0.85 | PDE5A (0.43) | PDE5AGAAHTTKMT2ANPSR1 | |
| SCHEMBL10479352 | 0.84 | CHRM2 (0.47) | PDE5AGAAHTTKMT2ANPSR1 | |
| SCHEMBL9768521 | 0.84 | PDE5A (0.52) | PDE5AGAAHTTKMT2ANPSR1 | |
| SCHEMBL9437957 | 0.84 | CHRM2 (0.47) | PDE5AGAAHTTKMT2ANPSR1 | |
| SCHEMBL9500848 | 0.84 | KMT2A (0.43) | PDE5AGAAHTTKMT2ANPSR1 | |
| SCHEMBL23406316 | 0.83 | SRC (0.43) | PDE5AGAAHTTKMT2ANPSR1 | |
| SCHEMBL3656115 | 0.83 | SRC (0.43) | PDE5AGAAHTTKMT2ANPSR1 | |
| SCHEMBL10475045 | 0.83 | SRC (0.43) | PDE5AGAAHTTKMT2ANPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0406169-A1 | 2,4-Dimethyl-6-s-alkyl-phenols | CIBA-GEIGY AG (CH) | 1991-01-02 | — | — | EP | disclosed |