Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.62 |
| ▸ | DRD4 | P21917 | 1/20 | 0.62 |
| ▸ | DRD3 | P35462 | 1/20 | 0.62 |
| ▸ | BRD4 | O60885 | 17/20 | 0.56 |
| ▸ | NSD3 | Q9BZ95 | 1/20 | 0.53 |
| ▸ | BRD2 | P25440 | 1/20 | 0.48 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.48 |
| ▸ | BRDT | Q58F21 | 1/20 | 0.48 |
| ▸ | HTR2A | P28223 | 1/20 | 0.47 |
| ▸ | HTR2C | P28335 | 1/20 | 0.47 |
| ▸ | HTR2B | P41595 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8484750 | 0.79 | DRD2 (0.62) | DRD2DRD4DRD3BRD4NSD3 | |
| SCHEMBL8482378 | 0.77 | DRD4 (1.00) | DRD2DRD4DRD3 | |
| Hydrochloric Acid SCHEMBL8484903 | 0.76 | DRD4 (0.97) | DRD2DRD4DRD3 | |
| SCHEMBL22730428 | 0.74 | BRD4 (1.00) | BRD4 | |
| SCHEMBL30558860 | 0.73 | DRD2 (0.52) | DRD2DRD4DRD3BRD4 | |
| SCHEMBL829129 | 0.72 | USP2 (0.52) | HTR2A | |
| SCHEMBL22730452 | 0.72 | BRD4 (0.70) | BRD4BRD2BRD3BRDT | |
| Hydrochloric Acid SCHEMBL829074 | 0.71 | USP2 (0.51) | HTR2A | |
| SCHEMBL22730504 | 0.71 | BRD4 (1.00) | BRD4 | |
| SCHEMBL22730387 | 0.71 | BRD4 (0.59) | BRD4BRD2BRD3BRDT |
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-5939436-A | Five-membered heteroaromatic compounds as dopamine receptor subtype ligands | MERCK SHARP & DOHME LTD. (GB) | 1999-08-17 | — | — | US | disclosed |