Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 3/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | LSS | P48449 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.38 |
| ▸ | HTR3A | P46098 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9266715 | 1.00 | DRD2 (0.46) | DRD2CYP2C9ESR2KDM4ETHRB | |
| SCHEMBL9264901 | 0.96 | DRD2 (0.43) | DRD2CYP2C9ESR2KDM4ETHRB | |
| SCHEMBL9267765 | 0.96 | DRD2 (0.43) | DRD2CYP2C9ESR2KDM4ETHRB | |
| SCHEMBL9264899 | 0.96 | DRD2 (0.43) | DRD2CYP2C9ESR2KDM4ETHRB | |
| SCHEMBL9273163 | 0.92 | DRD2 (0.45) | DRD2CYP2C9ESR2KDM4ETHRB | |
| SCHEMBL9273168 | 0.92 | DRD2 (0.45) | DRD2CYP2C9ESR2KDM4ETHRB | |
| SCHEMBL9271126 | 0.91 | DRD2 (0.44) | DRD2CYP2C9ESR2KDM4ETHRB | |
| SCHEMBL9271133 | 0.91 | DRD2 (0.44) | DRD2CYP2C9ESR2KDM4ETHRB | |
| SCHEMBL9273538 | 0.90 | DRD2 (0.43) | DRD2CYP2C9ESR2KDM4ETHRB | |
| SCHEMBL9273531 | 0.90 | DRD2 (0.43) | DRD2CYP2C9ESR2KDM4ETHRB |
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-5399689-A | Chlorophenylalkoxyalkyl compounds | HOFFMANN-LA ROCHE INC. (US) | 1995-03-21 | — | — | US | disclosed |