Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | PIN1 | Q13526 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29408204 | 0.81 | PRKAG1 (0.56) | KDM4ELMNATP53CYP1A2CYP2C19 | |
| SCHEMBL570062 | 0.79 | PIN1 (0.47) | KDM4ELMNATP53HCAR2MAPK1 | |
| SCHEMBL11622011 | 0.75 | KDM4E (0.47) | KDM4ETP53MAPK1ALDH1A1SMN1; SMN2 | |
| SCHEMBL10642212 | 0.75 | LMNA (0.44) | KDM4ELMNATP53MAPK1PIN1 | |
| SCHEMBL8887039 | 0.73 | ALDH1A1 (0.60) | KDM4ELMNATP53MAPK1CYP1A2 | |
| SCHEMBL2875437 | 0.72 | MAPK1 (0.63) | KDM4ETP53MAPK1CYP1A2CYP2C19 | |
| SCHEMBL16225421 | 0.72 | AKT2 (0.50) | KDM4ETP53MAPK1ALDH1A1SMN1; SMN2 | |
| SCHEMBL15799669 | 0.71 | ALPL (0.48) | KDM4ELMNATP53HCAR2MAPK1 | |
| SCHEMBL20028652 | 0.70 | KDM4E (0.46) | KDM4ELMNATP53MAPK1PIN1 | |
| SCHEMBL2198685 | 0.70 | IKBKB (0.43) | KDM4EHCAR2MAPK1PIN1ALDH1A1 |
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-1996012706-A1 | NOVEL ACID PYRAZOLE AND PYRAZOLONE DERIVATIVES FOR USE AS ENDOTHELIN RECEPTOR ANTAGONISTS | ROUSSEL UCLAF (FR) | 1996-05-02 | — | — | WO | disclosed |