Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.86 |
| ▸ | DRD4 | P21917 | 1/20 | 0.86 |
| ▸ | CES2 | O00748 | 1/20 | 0.65 |
| ▸ | BCHE | P06276 | 1/20 | 0.65 |
| ▸ | CES1 | P23141 | 1/20 | 0.65 |
| ▸ | ALDH3A1 | P30838 | 3/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.62 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11144969 | 0.99 | DRD2 (0.84) | DRD2DRD4CES2BCHECES1 | |
| SCHEMBL9097081 | 0.93 | DRD4 (1.00) | DRD2DRD4CES2BCHECES1 | |
| Hydrochloric Acid SCHEMBL9095750 | 0.90 | ALDH3A1 (0.72) | DRD2DRD4CES1ALDH3A1ALDH1A1 | |
| SCHEMBL9098077 | 0.88 | ALDH3A1 (0.69) | DRD2DRD4CES1ALDH3A1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL11153463 | 0.86 | DRD2 (0.67) | DRD2DRD4 | |
| SCHEMBL9095875 | 0.83 | DRD2 (0.83) | DRD2DRD4BCHECES1ALDH3A1 | |
| SCHEMBL9096595 | 0.81 | ALDH3A1 (0.80) | DRD2DRD4CES2BCHECES1 | |
| SCHEMBL11173918 | 0.80 | DRD2 (0.67) | DRD2DRD4 | |
| SCHEMBL3027106 | 0.80 | CES1 (1.00) | DRD2DRD4CES2BCHECES1 | |
| SCHEMBL4597126 | 0.79 | ALDH1A1 (0.77) | DRD2DRD4CES2BCHECES1 |
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-5585378-A | Composition containing an oxoindole compound | AKTIEBOLAGET ASTRA (SE) | 1996-12-17 | — | — | US | disclosed |