Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 13/20 | 1.00 |
| ▸ | DRD2 | P14416 | 12/20 | 1.00 |
| ▸ | DRD3 | P35462 | 11/20 | 1.00 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.51 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | ACHE | P22303 | 1/20 | 0.48 |
| ▸ | CCR3 | P51677 | 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 | |
|---|---|---|---|---|
| SCHEMBL20816392 | 0.78 | DRD2 (0.63) | DRD4DRD2DRD3RAB9AL3MBTL1 | |
| SCHEMBL4959931 | 0.77 | DRD2 (0.62) | DRD4DRD2DRD3RAB9AL3MBTL1 | |
| SCHEMBL4319291 | 0.76 | DRD2 (0.60) | DRD4DRD2DRD3RAB9AL3MBTL1 | |
| SCHEMBL8482373 | 0.73 | DRD4 (1.00) | DRD4DRD2DRD3KCNH2SIGMAR1 | |
| SCHEMBL9278989 | 0.73 | DRD4 (1.00) | DRD4DRD2DRD3KCNH2SIGMAR1 | |
| Hydrochloric Acid SCHEMBL8482360 | 0.72 | DRD4 (0.97) | DRD4DRD2DRD3KCNH2SIGMAR1 | |
| SCHEMBL8484877 | 0.71 | DRD4 (1.00) | DRD4DRD2DRD3KCNH2SIGMAR1 | |
| SCHEMBL8482378 | 0.71 | DRD4 (1.00) | DRD4DRD2DRD3KCNH2SIGMAR1 | |
| SCHEMBL2359215 | 0.71 | DRD2 (0.55) | DRD4DRD2DRD3RAB9AL3MBTL1 | |
| SCHEMBL4413466 | 0.71 | RAB9A (1.00) | RAB9AL3MBTL1KMT2ASMN1; SMN2LMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1996021660-A1 | FIVE-MEMBERED HETEROAROMATIC COMPOUNDS AS DOPAMINE RECEPTOR SUBTYPE LIGANDS | MERCK SHARP & DOHME LIMITED (GB) | 1996-07-18 | — | — | WO | claimed |
| US-5939436-A | Five-membered heteroaromatic compounds as dopamine receptor subtype ligands | MERCK SHARP & DOHME LTD. (GB) | 1999-08-17 | — | — | US | disclosed |
| WO-1996021660-A1 | FIVE-MEMBERED HETEROAROMATIC COMPOUNDS AS DOPAMINE RECEPTOR SUBTYPE LIGANDS | MERCK SHARP & DOHME LIMITED (GB) | 1996-07-18 | — | — | WO | disclosed |