Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1B | P35368 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.42 |
| ▸ | DAO | P14920 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | MPO | P05164 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7022008 | 1.00 | ADRA1B (0.42) | ADRA1BADORA3ADORA1ADORA2ADAO | |
| SCHEMBL7022190 | 0.88 | ADORA3 (0.41) | ADRA1BADORA3ADORA1ADORA2ADAO | |
| SCHEMBL7014576 | 0.88 | ADORA3 (0.41) | ADRA1BADORA3ADORA1ADORA2ADAO | |
| SCHEMBL7017940 | 0.81 | KDM4E (0.41) | ADRA1BADORA3ADORA2AALDH1A1HPGD | |
| SCHEMBL7017938 | 0.81 | KDM4E (0.41) | ADRA1BADORA3ADORA2AALDH1A1HPGD | |
| SCHEMBL7014430 | 0.81 | MAPT (0.48) | ADRA1BPARP1CYP1A2ALDH1A1KDM4E | |
| SCHEMBL7014427 | 0.81 | MAPT (0.48) | ADRA1BPARP1CYP1A2ALDH1A1KDM4E | |
| SCHEMBL30970867 | 0.79 | ADORA3 (0.62) | ADRA1BADORA3ADORA1ADORA2ADAO | |
| SCHEMBL11868273 | 0.77 | ADORA3 (0.53) | ADRA1BADORA3ADORA1ADORA2AALDH1A1 | |
| SCHEMBL7019512 | 0.76 | ADRA1B (0.43) | ADRA1BADORA3ADORA1ADORA2ADAO |
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 |
|---|---|---|---|---|---|---|---|
| WO-2003089416-A1 | SUBSTITUTED PYRIMIDINE-2,4(1H,3H)-DIONES FOR USE AS MATRIX METALLOPROTEINASE (MMP) INHIBITORS | IBFB GMBH (DE) | 2003-10-30 | — | — | WO | disclosed |
| EP-1357114-A1 | Substituted pyrimidin-2,4(1H,3H)-diones as inhibitors of Matrix Metalloproteinases (MMP) | IBFB GmbH Privates Institut für biomedizinische Forschung und Beratung (DE) | 2003-10-29 | — | — | EP | disclosed |