Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 7/20 | 0.38 |
| ▸ | DRD1 | P21728 | 7/20 | 0.38 |
| ▸ | DRD4 | P21917 | 7/20 | 0.38 |
| ▸ | DRD5 | P21918 | 7/20 | 0.38 |
| ▸ | DRD3 | P35462 | 7/20 | 0.38 |
| ▸ | TYR | P14679 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 6/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 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 | |
|---|---|---|---|---|
| SCHEMBL5619303 | 0.82 | ESR2 (0.56) | ESR2TYRMEN1CYP3A4MAPT | |
| Tetrabuthylammonium SCHEMBL7706138 | 0.81 | TYR (0.41) | HTR1ADRD1DRD4DRD5DRD3 | |
| SCHEMBL31545041 | 0.68 | CYP2C9 (0.43) | ESR2DRD3TYRMEN1CYP3A4 | |
| Butylamine SCHEMBL28820128 | 0.68 | IKBKB (0.40) | HTR1ADRD1DRD4DRD5DRD3 | |
| SCHEMBL29871375 | 0.66 | ALDH1A1 (0.43) | ESR2TYRMEN1CYP3A4MAPT | |
| SCHEMBL3162433 | 0.66 | ALDH1A1 (0.43) | ESR2TYRMEN1CYP3A4MAPT | |
| SCHEMBL1980422 | 0.65 | NPC1 (0.45) | HTR1ADRD1DRD4DRD5DRD3 | |
| SCHEMBL6433125 | 0.65 | ESR2 (0.59) | ESR2TYRMEN1CYP3A4MAPT | |
| SCHEMBL5935862 | 0.65 | ALDH1A1 (0.46) | ESR2TYRMAPT | |
| SCHEMBL19892266 | 0.65 | ALDH1A1 (0.46) | ESR2TYRMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1165495-A1 | RESORCINOL DERIVATIVES | PFIZER INC. (US) | 2002-01-02 | — | — | EP | disclosed |
| WO-2000056702-A1 | RESORCINOL DERIVATIVES | PFIZER INC. (US) | 2000-09-28 | — | — | WO | disclosed |