Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | SMO | Q99835 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 5/20 | 0.34 |
| ▸ | RAB9A | P51151 | 5/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.34 |
| ▸ | CASP3 | P42574 | 1/20 | 0.34 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.34 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.34 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | MAOB | P27338 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | APAF1 | O14727 | 1/20 | 0.34 |
| ▸ | TDP2 | O95551 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8547106 | 0.88 | SMO (0.41) | ADORA2AALDH1A1SMOCYP1A2NPC1 | |
| SCHEMBL8549331 | 0.85 | HSD11B1 (0.42) | HSD11B1ALDH1A1SMOCYP1A2NPC1 | |
| SCHEMBL8550501 | 0.82 | HSD11B1 (0.34) | HSD11B1ALDH1A1AR | |
| SCHEMBL8552471 | 0.82 | ADORA2A (0.40) | ADORA2AALDH1A1SMOCYP1A2NPC1 | |
| SCHEMBL8546655 | 0.82 | MAPK1 (0.42) | HSD11B1ALDH1A1CYP1A2NPC1RAB9A | |
| SCHEMBL8547547 | 0.79 | SMO (0.44) | ADORA2AALDH1A1SMONPC1RAB9A | |
| SCHEMBL8548393 | 0.79 | HSD11B1 (0.44) | HSD11B1KDR | |
| SCHEMBL8549262 | 0.78 | ALDH1A1 (0.41) | ADORA2AALDH1A1CYP1A2SMN1; SMN2HPGD | |
| SCHEMBL8372792 | 0.76 | PLAU (0.43) | ADORA2AALDH1A1SMOCYP1A2HPGD | |
| Hydrochloric Acid SCHEMBL8551595 | 0.75 | PLAU (0.42) | ADORA2AALDH1A1SMOCYP1A2HPGD |
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-0825187-A1 | Condensed pyridazinyl guanidines, their production and use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-02-25 | — | — | EP | disclosed |