Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 1/20 | 0.60 |
| ▸ | HRH4 | Q9H3N8 | 4/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
| ▸ | HRH2 | P25021 | 1/20 | 0.40 |
| ▸ | HRH1 | P35367 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | HTR7 | P34969 | 2/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.39 |
| ▸ | HTR3A | P46098 | 1/20 | 0.39 |
| ▸ | HTR6 | P50406 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL8000064 | 0.89 | DRD4 (0.50) | DRD4HRH4NPC1KDRHTR7 | |
| SCHEMBL8000470 | 0.81 | DRD4 (0.66) | DRD4HRH4KDRHRH2HRH1 | |
| SCHEMBL8009072 | 0.79 | DRD4 (0.73) | DRD4HRH4HRH2HRH1HRH3 | |
| SCHEMBL8018843 | 0.77 | DRD4 (0.53) | DRD4HRH4NPC1HRH2HRH1 | |
| SCHEMBL8009156 | 0.77 | DRD4 (0.67) | DRD4HRH4HRH2HRH1HRH3 | |
| SCHEMBL8009153 | 0.75 | DRD4 (0.54) | DRD4HRH4NPC1KDRHRH2 | |
| SCHEMBL8012111 | 0.75 | DRD4 (1.00) | DRD4HRH4NPC1KDRHRH2 | |
| Oxalic Acid SCHEMBL8011723 | 0.75 | DRD4 (0.67) | DRD4HRH4HRH2HRH1HRH3 | |
| SCHEMBL8015532 | 0.73 | DRD4 (0.64) | DRD4HRH4NPC1KDRHRH2 | |
| SCHEMBL605567 | 0.72 | HRH4 (1.00) | HRH4HRH2HRH1HRH3HTR2B |
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 |
|---|---|---|---|---|---|---|---|
| EP-0724572-A1 | FUSED TRICYCLIC HETEROAROMATIC DERIVATIVES AS DOPAMINE RECEPTOR SUBTYPE LIGANDS | MERCK SHARP & DOHME LTD. (GB) | 1996-08-07 | — | — | EP | disclosed |