Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | GCGR | P47871 | 1/20 | 0.38 |
| ▸ | MIF | P14174 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.37 |
| ▸ | PDE5A | O76074 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | PDE4A | P27815 | 1/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 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 | |
|---|---|---|---|---|
| SCHEMBL9753170 | 0.88 | MAPK14 (0.44) | EGFRGCGRADORA1ADORA2A | |
| SCHEMBL9753346 | 0.83 | GCGR (0.39) | EGFRGCGRMIFKMT2AMEN1 | |
| SCHEMBL15070164 | 0.81 | EGFR (0.44) | EGFRKCNH2HDAC1MAPK1MIF | |
| SCHEMBL9753002 | 0.80 | TGFBR1 (0.36) | EGFRKCNH2ADORA1ADORA2A | |
| SCHEMBL9753098 | 0.77 | GCGR (0.40) | EGFRGCGRMIFADORA1ADORA2A | |
| SCHEMBL9753063 | 0.76 | EGFR (0.39) | EGFRKCNH2HDAC1MAPK1MIF | |
| SCHEMBL9753419 | 0.75 | GRM2 (0.36) | GCGR | |
| SCHEMBL9753865 | 0.74 | EGFR (0.59) | SMN1; SMN2EGFRMIFKMT2AMEN1 | |
| SCHEMBL9753315 | 0.72 | MAPK14 (0.39) | EGFRMIFKMT2AMEN1ALDH1A1 | |
| SCHEMBL9753122 | 0.72 | EGFR (0.38) | EGFRKCNH2HDAC1MAPK1MIF |
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 |
|---|---|---|---|---|---|---|---|
| WO-1991018903-A1 | PYRROLOPYRIDAZINE COMPOUNDS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1991-12-12 | — | — | WO | disclosed |