Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.55 |
| ▸ | HPGDS | O60760 | 1/20 | 0.51 |
| ▸ | PDE3A | Q14432 | 4/20 | 0.51 |
| ▸ | PDE3B | Q13370 | 3/20 | 0.51 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | LDLR | P01130 | 1/20 | 0.42 |
| ▸ | PCSK9 | Q8NBP7 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | COMT | P21964 | 1/20 | 0.40 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | PDE5A | O76074 | 1/20 | 0.37 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL822807 | 0.75 | HPGDS (0.77) | CYP1A2HPGDSPDE3APDE3BLMNA | |
| SCHEMBL10653106 | 0.73 | PDE3A (0.64) | CYP1A2PDE3APDE3BLMNAKMT2A | |
| SCHEMBL482059 | 0.73 | CYP1A2 (1.00) | CYP1A2PDE3APDE3BLMNAKMT2A | |
| SCHEMBL7290613 | 0.72 | CYP1A2 (0.59) | CYP1A2PDE3APDE3BLMNAKMT2A | |
| SCHEMBL2835874 | 0.72 | HPGDS (0.67) | CYP1A2HPGDSPDE3APDE3BKMT2A | |
| SCHEMBL7689907 | 0.71 | CYP1A2 (0.96) | CYP1A2PDE3APDE3BLMNAKMT2A | |
| SCHEMBL2365544 | 0.68 | HPGDS (1.00) | CYP1A2HPGDSPDE3APDE3BLMNA | |
| SCHEMBL10651088 | 0.68 | PDE3B (1.00) | HPGDSPDE3APDE3BLMNALDLR | |
| SCHEMBL27410416 | 0.67 | COMT (0.56) | CYP1A2HPGDSPDE3APDE3BLDLR | |
| SCHEMBL8888651 | 0.67 | CYP1A2 (0.55) | CYP1A2PDE3ALMNAKMT2AMEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0125749-B1 | IMIDAZOLYL-PYRIDAZINONES | WARNER-LAMBERT COMPANY (US) | 1988-10-05 | — | — | EP | disclosed |
| US-4521416-A | 4,5-Dihydro-6-[(substituted)-1H-imidazol-4-yl or 5-yl]-3(2H)-pyridazinones and 6-[(substituted)-1H-imidazol-4-yl or 5-yl]-3(2H)-pyridazinones | WARNER-LAMBERT COMPANY (US) | 1985-06-04 | — | — | US | disclosed |
| EP-0125749-A2 | Imidazolyl-pyridazinones | WARNER-LAMBERT COMPANY (US) | 1984-11-21 | — | — | EP | disclosed |