Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.57 |
| ▸ | NPC1 | O15118 | 3/20 | 0.57 |
| ▸ | MEN1 | O00255 | 2/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.41 |
| ▸ | RELA | Q04206 | 1/20 | 0.41 |
| ▸ | FYN | P06241 | 1/20 | 0.40 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6582037 | 0.73 | BRD4 (0.45) | MEN1KMT2ACACNA1FOPRM1DRD3 | |
| SCHEMBL7494123 | 0.72 | RAB9A (0.68) | SMN1; SMN2NPC1KMT2AKDM4ETDP1 | |
| SCHEMBL13150855 | 0.70 | HTR7 (0.55) | MEN1KMT2AALDH1A1LMNACACNA1F | |
| SCHEMBL6582630 | 0.70 | MEN1 (0.40) | SMN1; SMN2NPC1MEN1KMT2AKDM4E | |
| SCHEMBL13792157 | 0.67 | KMT2A (0.53) | SMN1; SMN2NPC1MEN1KMT2AKDM4E | |
| SCHEMBL31128113 | 0.67 | LMNA (0.57) | SMN1; SMN2NPC1MEN1KMT2AKDM4E | |
| SCHEMBL4313180 | 0.67 | NPC1 (0.57) | SMN1; SMN2NPC1MEN1KMT2AKDM4E | |
| SCHEMBL29033970 | 0.67 | KDM4E (0.50) | SMN1; SMN2NPC1MEN1KMT2AKDM4E | |
| SCHEMBL30502863 | 0.67 | KDM4E (0.50) | SMN1; SMN2NPC1MEN1KMT2AKDM4E | |
| Hydrochloric Acid SCHEMBL2188431 | 0.66 | KMT2A (0.52) | SMN1; SMN2NPC1MEN1KMT2AKDM4E |
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 |