Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 9/20 | 0.43 |
| ▸ | TBXA2R | P21731 | 3/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.43 |
| ▸ | HTR1A | P08908 | 2/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.43 |
| ▸ | DRD1 | P21728 | 2/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.43 |
| ▸ | DRD3 | P35462 | 2/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.43 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.43 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.43 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.43 |
| ▸ | KCNK2 | O95069 | 1/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7266308 | 0.89 | TBXA2R (0.54) | ADORA3TBXA2RADRA1ASLC6A3HTR1A | |
| SCHEMBL7268196 | 0.78 | ADORA3 (0.52) | ADORA3TBXA2RADRA1ASLC6A3HTR1A | |
| SCHEMBL7275805 | 0.74 | TBXA2R (0.57) | ADORA3TBXA2RADRA1ASLC6A3HTR1A | |
| SCHEMBL9868491 | 0.72 | TSHR (0.47) | ADORA3TBXA2RADRA1ASLC6A3HTR1A | |
| SCHEMBL10615427 | 0.72 | ADORA3 (0.52) | ADORA3TBXA2RADRA1ASLC6A3HTR1A | |
| SCHEMBL11520735 | 0.72 | CACNA1C (0.54) | ADORA3TBXA2RADRA1ASLC6A3HTR1A | |
| SCHEMBL7467067 | 0.72 | CACNA1C (0.51) | ADORA3TBXA2RADRA1ASLC6A3HTR1A | |
| SCHEMBL9833019 | 0.71 | CACNA1C (0.64) | ADORA3TBXA2RADRA1ASLC6A3SLC6A2 | |
| SCHEMBL7467069 | 0.71 | ADORA3 (0.50) | ADORA3TBXA2RADRA1ASLC6A3HTR1A | |
| SCHEMBL9809443 | 0.70 | ADORA3 (0.49) | ADORA3TBXA2RADRA1ASLC6A3HTR1A |
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-4988713-A | 2-selenomethyl-1,4-dihydropyridines having calcium-antagonistic properties and pharmaceutical compositions containing them | BOEHRINGER BIOCHEMIA ROBIN S.P.A. (IT) | 1991-01-29 | — | — | US | disclosed |