Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | DRD2 | P14416 | 9/20 | 0.46 |
| ▸ | DRD4 | P21917 | 8/20 | 0.46 |
| ▸ | DRD3 | P35462 | 8/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 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 | |
|---|---|---|---|---|
| SCHEMBL9428569 | 0.93 | TAAR1 (0.60) | ALDH1A1TAAR1HPGDSMN1; SMN2CYP1A2 | |
| SCHEMBL9387817 | 0.80 | PKM (0.56) | ALDH1A1TAAR1HPGDSMN1; SMN2CYP1A2 | |
| SCHEMBL10839174 | 0.79 | ALDH1A1 (0.53) | ALDH1A1TAAR1HPGDSMN1; SMN2CYP1A2 | |
| SCHEMBL9428964 | 0.77 | MAPK1 (0.49) | ALDH1A1TAAR1HPGDSMN1; SMN2CYP1A2 | |
| SCHEMBL9384556 | 0.77 | PKM (0.58) | TAAR1HPGDSMN1; SMN2CYP1A2MAPK1 | |
| SCHEMBL9428388 | 0.76 | CYP1A2 (0.49) | ALDH1A1TAAR1HPGDSMN1; SMN2CYP1A2 | |
| SCHEMBL11485825 | 0.74 | SMN1; SMN2 (0.76) | ALDH1A1TAAR1HPGDSMN1; SMN2CYP1A2 | |
| SCHEMBL9428768 | 0.74 | MAPT (0.48) | ALDH1A1TAAR1HPGDSMN1; SMN2CYP1A2 | |
| SCHEMBL9205226 | 0.74 | MAPK1 (0.64) | ALDH1A1TAAR1HPGDSMN1; SMN2CYP1A2 | |
| SCHEMBL9383443 | 0.74 | SLC22A2 (0.44) | ALDH1A1TAAR1HPGDSMN1; SMN2CYP1A2 |
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 |