Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.60 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.42 |
| ▸ | HTR1A | P08908 | 2/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.42 |
| ▸ | DRD1 | P21728 | 2/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.42 |
| ▸ | DRD3 | P35462 | 2/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.42 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8892337 | 0.81 | ALDH1A1 (0.53) | SMN1; SMN2ALDH1A1LMNACYP17A1MEN1 | |
| SCHEMBL9243522 | 0.73 | ALDH1A1 (0.74) | SMN1; SMN2ALDH1A1SLC6A4SLC6A3KCNH2 | |
| SCHEMBL1149306 | 0.70 | TP53 (0.34) | TP53 | |
| SCHEMBL10573316 | 0.70 | ALDH1A1 (0.69) | SMN1; SMN2ALDH1A1SLC6A4SLC6A3KCNH2 | |
| SCHEMBL8892871 | 0.69 | ALDH1A1 (0.53) | SMN1; SMN2ALDH1A1SLC6A4SLC6A3KCNH2 | |
| Hydrochloric Acid SCHEMBL10576875 | 0.69 | ALDH1A1 (0.71) | SMN1; SMN2ALDH1A1SLC6A4SLC6A3KCNH2 | |
| SCHEMBL8892780 | 0.67 | SIGMAR1 (0.55) | SMN1; SMN2ALDH1A1SLC6A4SLC6A3KCNH2 | |
| SCHEMBL8893913 | 0.65 | CYP19A1 (0.41) | SMN1; SMN2ALDH1A1SLC6A4SLC6A3KCNH2 | |
| SCHEMBL27843932 | 0.64 | CYP19A1 (0.47) | ALDH1A1KCNH2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL30617893 | 0.61 | CHRM2 (0.84) | SMN1; SMN2ALDH1A1SLC6A4SLC6A3KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1997027175-A1 | SUBSTITUTED ETHYL α,α - DIARYLMETHYL ETHER DERIVATIVES | GUILFORD PHARMACEUTICALS INC. (US) | 1997-07-31 | — | — | WO | claimed |