Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.55 |
| ▸ | HTR7 | P34969 | 5/20 | 0.54 |
| ▸ | DRD2 | P14416 | 3/20 | 0.51 |
| ▸ | DRD3 | P35462 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.51 |
| ▸ | DRD5 | P21918 | 1/20 | 0.51 |
| ▸ | HTR2A | P28223 | 1/20 | 0.49 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL7680687 | 0.93 | SMN1; SMN2 (0.59) | SIGMAR1HTR7DRD2DRD3ALDH1A1 | |
| SCHEMBL13875122 | 0.86 | SIGMAR1 (0.71) | SIGMAR1HTR7DRD2DRD3ALDH1A1 | |
| 2-Mercaptopyrimidine SCHEMBL7674571 | 0.83 | DRD2 (0.62) | SIGMAR1HTR7DRD2DRD3ALDH1A1 | |
| SCHEMBL13875120 | 0.82 | SIGMAR1 (0.69) | SIGMAR1HTR7DRD2DRD3ALDH1A1 | |
| 2-Mercaptopyridine SCHEMBL8140323 | 0.81 | DRD2 (0.64) | SIGMAR1HTR7DRD2DRD3ALDH1A1 | |
| SCHEMBL7677748 | 0.79 | SIGMAR1 (0.54) | SIGMAR1HTR7DRD2DRD3ADRA1A | |
| SCHEMBL7680682 | 0.79 | SIGMAR1 (0.53) | SIGMAR1HTR7DRD2DRD3ALDH1A1 | |
| SCHEMBL2927397 | 0.78 | ALDH1A1 (0.77) | SIGMAR1HTR7DRD2ALDH1A1SMN1; SMN2 | |
| SCHEMBL11465528 | 0.78 | SIGMAR1 (0.76) | SIGMAR1HTR7DRD2DRD3ALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL11284383 | 0.77 | ALDH1A1 (0.75) | SIGMAR1HTR7DRD2ALDH1A1SMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6403593-B1 | DOPAMINE RECEPTOR | ABBOTT LABORATORIES | 2002-06-11 | — | — | US | disclosed |
| US-6124294-A | COMPOUNDS HAVING HIGH AFFINITY FOR DOPAMINE D3 RECEPTOR; USED TO TREAT DISORDERS WHICH RESPOND TO DOPAMINE D3 LIGANDS | BASF AKTIENGESELLSCHAFT (DE) | 2000-09-26 | — | — | US | disclosed |