Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 5/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6953284 | 1.00 | ALDH1A1 (0.42) | ALDH1A1GAAMEN1KMT2AKDM4E | |
| SCHEMBL8427590 | 0.96 | MEN1 (0.39) | ALDH1A1GAAMEN1KMT2AKDM4E | |
| SCHEMBL8427587 | 0.96 | MEN1 (0.39) | ALDH1A1GAAMEN1KMT2AKDM4E | |
| SCHEMBL6947197 | 0.93 | KDM4E (0.45) | ALDH1A1GAAMEN1KMT2AKDM4E | |
| SCHEMBL6947196 | 0.93 | KDM4E (0.45) | ALDH1A1GAAMEN1KMT2AKDM4E | |
| SCHEMBL8011099 | 0.92 | LMNA (0.43) | ALDH1A1GAAMEN1KMT2AKDM4E | |
| SCHEMBL8022346 | 0.88 | PTGS2 (0.42) | ALDH1A1GAAMEN1KMT2AKDM4E | |
| SCHEMBL8423675 | 0.88 | PTGS2 (0.42) | ALDH1A1GAAMEN1KMT2AKDM4E | |
| SCHEMBL6951965 | 0.86 | KDM4E (0.43) | ALDH1A1GAAMEN1KMT2AKDM4E | |
| SCHEMBL6951963 | 0.86 | KDM4E (0.43) | ALDH1A1GAAMEN1KMT2AKDM4E |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0743304-B1 | 4-(Arylaminomethylene)-2,4-dihydro-pyrazol-3-ones | MERCK PATENT GMBH (DE) | 2003-03-26 | — | — | EP | disclosed |
| EP-0930881-A1 | PYRAZOLINONES TO TREAT DISTURBANCES OF POTENCY | MERCK PATENT GmbH (DE) | 1999-07-28 | — | — | EP | disclosed |
| WO-1998016224-A1 | PYRAZOLINONES TO TREAT DISTURBANCES OF POTENCY | MERCK PATENT GMBH (DE) | 1998-04-23 | — | — | WO | disclosed |
| EP-0743304-A1 | 4-(Arylaminomethylene)-2,4-dihydro-pyrazol-3-ones | MERCK PATENT GmbH (DE) | 1996-11-20 | — | — | EP | disclosed |