Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM5B | Q9UGL1 | 18/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7740293 | 0.71 | HSD17B10 (0.43) | KDM4ENPC1ALDH1A1TP53HPGD | |
| SCHEMBL12883857 | 0.67 | PARP1 (0.51) | KDM4EALDH1A1HPGDRAB9ASMN1; SMN2 | |
| SCHEMBL30773025 | 0.67 | KDM4E (0.45) | KDM4ENPC1ALDH1A1TP53HPGD | |
| SCHEMBL203256 | 0.65 | KDM5B (0.43) | KDM5BKDM4ESMN1; SMN2 | |
| SCHEMBL7126019 | 0.64 | KDM5B (0.44) | KDM5BKDM4E | |
| SCHEMBL7665757 | 0.64 | KDM5B (0.44) | KDM5B | |
| SCHEMBL11447666 | 0.61 | MAPK1 (0.59) | KDM4EALDH1A1SMN1; SMN2HSD17B10 | |
| SCHEMBL17229160 | 0.61 | KDM4E (0.53) | KDM4ENPC1ALDH1A1TP53HPGD | |
| SCHEMBL11779144 | 0.60 | KDM4E (0.39) | KDM4ENPC1ALDH1A1TP53HPGD | |
| SCHEMBL20704529 | 0.60 | HPGD (0.49) | KDM4ENPC1ALDH1A1TP53HPGD |
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-1993012113-A1 | 3-SUBSTITUTED IMIDAZO (1,5-a) AND IMIDAZO (1,5-a)-TRIAZOLO (1,5-c) QUINOXALINES AND QUINAZOLINES WITH CNS ACTIVITY | THE UPJOHN COMPANY (US) | 1993-06-24 | — | — | WO | disclosed |