Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 1/20 | 0.44 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.44 |
| ▸ | CCR1 | P32246 | 3/20 | 0.43 |
| ▸ | CCR5 | P51681 | 3/20 | 0.43 |
| ▸ | CCR8 | P51685 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | METAP1 | P53582 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | DOHH | Q9BU89 | 1/20 | 0.42 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.42 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 4/20 | 0.41 |
| ▸ | TP53 | P04637 | 4/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9807627 | 0.84 | METAP1 (0.47) | ADORA2AADORA1CCR1CCR5CCR8 | |
| SCHEMBL8552965 | 0.78 | PLAU (0.44) | ADORA2AADORA1CCR1CCR5CCR8 | |
| SCHEMBL8551380 | 0.75 | LMNA (0.45) | ADORA2AADORA1KDM4ELMNACYP1A2 | |
| SCHEMBL8552963 | 0.75 | ADORA2A (0.39) | ADORA2AADORA1CCR1CCR5CCR8 | |
| SCHEMBL8549645 | 0.72 | LRRK2 (0.53) | CCR1CCR5CCR8KDM4ELMNA | |
| SCHEMBL7952022 | 0.72 | KDM4E (0.70) | ADORA2AADORA1CCR1CCR5CCR8 | |
| SCHEMBL7236265 | 0.71 | KDM4E (0.59) | ADORA2AADORA1CCR1CCR5CCR8 | |
| SCHEMBL15075728 | 0.69 | NPC1 (0.62) | CCR1CCR5CCR8KDM4ELMNA | |
| SCHEMBL16672906 | 0.69 | KDM4E (0.68) | CCR1CCR5CCR8KDM4ELMNA | |
| SCHEMBL8429326 | 0.69 | CCR1 (0.64) | ADORA2AADORA1CCR1CCR5CCR8 |
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 |