Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.37 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.37 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | SLC47A2 | Q86VL8 | 1/20 | 0.37 |
| ▸ | SLC47A1 | Q96FL8 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9429025 | 0.86 | ADRB1 (0.36) | ADRB2TAAR1ADORA2AADORA1RXFP1 | |
| SCHEMBL9429655 | 0.86 | ADRB2 (0.39) | ADRB2TAAR1ADORA2AADORA1RXFP1 | |
| SCHEMBL9436714 | 0.86 | SLC22A2 (0.43) | ADRB2TAAR1ADORA2AADORA1RXFP1 | |
| SCHEMBL9383178 | 0.85 | KCNH2 (0.53) | KCNH2SLC22A2ADRB1SLC6A4SLC47A2 | |
| SCHEMBL9428345 | 0.83 | SLC22A2 (0.40) | TAAR1RXFP1KCNH2SLC22A2ADRB1 | |
| SCHEMBL9869584 | 0.82 | KCNH2 (0.52) | KCNH2SLC22A2ADRB1SLC6A4SLC47A2 | |
| Oxalic Acid SCHEMBL9387858 | 0.78 | KCNH2 (0.51) | KCNH2SLC22A2ADRB1SLC6A4SLC47A2 | |
| SCHEMBL9385760 | 0.78 | KCNH2 (0.52) | KCNH2SLC22A2ADRB1SLC6A4SLC47A2 | |
| SCHEMBL9429721 | 0.77 | GRIN1 (0.46) | KCNH2SMN1; SMN2ALDH1A1HPGD | |
| SCHEMBL9428502 | 0.76 | DRD2 (0.47) | ALDH1A1 |
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-5332739-A | Pyrimidinedione derivatives and antiarrhythmic agents containing same | MITSUI TOATSU CHEMICALS, INCORPORATED (JP) | 1994-07-26 | — | — | US | disclosed |
| EP-0454498-A2 | Pyrimidinedione derivatives and antiarrhythmic agents containing same | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1991-10-30 | — | — | EP | disclosed |