Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.45 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.44 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.42 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | MMP12 | P39900 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | GGPS1 | O95749 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | GRM5 | P41594 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1852576 | 0.98 | KCNH2 (0.48) | KCNH2FFAR1FFAR4MMP2MMP12 | |
| SCHEMBL8846088 | 0.98 | KCNH2 (0.48) | KCNH2FFAR1FFAR4MMP2MMP12 | |
| SCHEMBL7680519 | 0.98 | KCNH2 (0.48) | KCNH2FFAR1FFAR4MMP2MMP12 | |
| SCHEMBL10795164 | 0.98 | KCNH2 (0.48) | KCNH2FFAR1FFAR4MMP2MMP12 | |
| SCHEMBL493774 | 0.95 | FFAR1 (0.45) | KCNH2FFAR1FFAR4MMP2MMP12 | |
| SCHEMBL9559955 | 0.88 | FFAR1 (0.52) | FFAR1FFAR4MAPTCYP3A4TSHR | |
| SCHEMBL2233459 | 0.81 | FFAR1 (0.52) | KCNH2FFAR1FFAR4MMP2MMP12 | |
| SCHEMBL10752111 | 0.80 | FFAR1 (0.47) | KCNH2FFAR1FFAR4MMP2MMP12 | |
| SCHEMBL3899508 | 0.80 | FFAR1 (0.50) | FFAR1ALDH1A1 | |
| SCHEMBL30688451 | 0.80 | FFAR1 (0.50) | FFAR1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0503079-A1 | PYRIDAZINONE-SUBSTITUTED ETHYNYLPHENYL DERIVATIVE AND REMEDY FOR CIRCULATORY ORGAN DISEASE CONTAINING THE SAME AS ACTIVE INGREDIENT | KAKEN PHARMACEUTICAL CO., LTD. (JP) | 1992-09-16 | — | — | EP | disclosed |