Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 3/20 | 0.36 |
| ▸ | THRB | P10828 | 3/20 | 0.36 |
| ▸ | LTA4H | P09960 | 2/20 | 0.35 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 4/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 5/20 | 0.32 |
| ▸ | TLR4 | O00206 | 1/20 | 0.31 |
| ▸ | GSTA1 | P08263 | 1/20 | 0.31 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8924858 | 0.90 | PTGS1 (0.30) | LTA4H | |
| SCHEMBL28974852 | 0.86 | LTA4H (0.37) | THRATHRBLTA4HNR5A1ESR1 | |
| SCHEMBL28974964 | 0.84 | LTA4H (0.42) | THRATHRBLTA4HNR5A1ESR1 | |
| SCHEMBL8923275 | 0.83 | GAA (0.33) | — | |
| SCHEMBL8923873 | 0.82 | IMPDH2 (0.32) | — | |
| SCHEMBL8960395 | 0.81 | ADRA1D (0.30) | — | |
| SCHEMBL28974851 | 0.79 | LTA4H (0.37) | THRATHRBLTA4HNR5A1ESR1 | |
| SCHEMBL25330453 | 0.77 | LTA4H (0.38) | THRATHRBLTA4HNR5A1ESR1 | |
| SCHEMBL30356522 | 0.77 | LTA4H (0.38) | THRATHRBLTA4HNR5A1ESR1 | |
| SCHEMBL5589188 | 0.77 | LTA4H (0.40) | THRATHRBLTA4HNR5A1ESR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5624961-A | Benzylaminoethoxybenzene derivatives, production thereof and use thereof | JAPAN TOBACCO INC. (JP) | 1997-04-29 | — | — | US | disclosed |
| EP-0693474-A1 | NOVEL BENZYLAMINOETHOXYBENZENE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF | Toyo Boseki Kabushiki Kaisha (JP) | 1996-01-24 | — | — | EP | disclosed |