Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | PIM1 | P11309 | 3/20 | 0.52 |
| ▸ | MAPK13 | O15264 | 3/20 | 0.52 |
| ▸ | GSK3A | P49840 | 2/20 | 0.50 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.50 |
| ▸ | AKT1 | P31749 | 1/20 | 0.50 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.50 |
| ▸ | NEK2 | P51955 | 1/20 | 0.50 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.50 |
| ▸ | PLK3 | Q9H4B4 | 1/20 | 0.50 |
| ▸ | LIMK1 | P53667 | 2/20 | 0.48 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.47 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.47 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.47 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.47 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.45 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | EPHA2 | P29317 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7364870 | 0.90 | BRAF (0.46) | KDM4EALDH1A1PIM1MAPK13GSK3A | |
| SCHEMBL7362153 | 0.89 | KDM4E (0.64) | KDM4EALDH1A1PIM1MAPK13GSK3A | |
| SCHEMBL7365603 | 0.87 | TLR8 (0.54) | KDM4EALDH1A1PIM1MAPK13GSK3A | |
| SCHEMBL7360098 | 0.85 | MAP2K1 (0.56) | KDM4EALDH1A1PIM1MAPK13GSK3A | |
| SCHEMBL7369929 | 0.85 | KDM4E (0.55) | KDM4EALDH1A1PIM1MAPK13GSK3A | |
| SCHEMBL7369743 | 0.85 | KDM4E (0.52) | KDM4EALDH1A1PIM1MAPK13GSK3A | |
| SCHEMBL7363924 | 0.83 | KDM4E (0.58) | KDM4EALDH1A1PIM1MAPK13GSK3A | |
| SCHEMBL7365839 | 0.83 | KDM4E (0.50) | KDM4EALDH1A1PIM1MAPK13GSK3A | |
| SCHEMBL7366580 | 0.82 | MAP2K1 (0.55) | KDM4EALDH1A1PIM1MAPK13GSK3A | |
| SCHEMBL7361400 | 0.82 | CLK4 (0.62) | KDM4EALDH1A1PIM1MAPK13GSK3A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4521422-A | ANTICONVULSANT, ANTIEPILEPTIC AGENTS, SEDATIVES, MUSCLE RELAXANTS | AMERICAN CYANAMID COMPANY (US) | 1985-06-04 | — | — | US | disclosed |
| EP-0129847-A2 | Aryl and heteroaryl[7-(aryl and heteroaryl)-pyrazolo-[1,5-a]-pyrimidin-3-yl]methanones | AMERICAN CYANAMID COMPANY (US) | 1985-01-02 | — | — | EP | disclosed |