Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.66 |
| ▸ | NPC1 | O15118 | 1/20 | 0.66 |
| ▸ | POLB | P06746 | 1/20 | 0.66 |
| ▸ | HTT | P42858 | 1/20 | 0.66 |
| ▸ | RAB9A | P51151 | 1/20 | 0.66 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.66 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.60 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.60 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.60 |
| ▸ | SLC2A1 | P11166 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL19807761 | 0.97 | KDM4E (0.67) | KDM4ENPC1POLBHTTRAB9A | |
| SCHEMBL29432752 | 0.80 | KDM4E (0.65) | KDM4ENPC1POLBHTTRAB9A | |
| SCHEMBL28630208 | 0.80 | NPC1 (0.61) | KDM4ENPC1POLBHTTRAB9A | |
| SCHEMBL28630911 | 0.80 | NPC1 (0.60) | KDM4ENPC1POLBHTTRAB9A | |
| SCHEMBL28615473 | 0.79 | NPC1 (0.60) | KDM4ENPC1POLBHTTRAB9A | |
| SCHEMBL28620514 | 0.78 | NPC1 (0.59) | KDM4ENPC1POLBHTTRAB9A | |
| SCHEMBL28616235 | 0.78 | KDM4E (0.58) | KDM4ENPC1POLBHTTRAB9A | |
| SCHEMBL28622693 | 0.78 | NPC1 (0.57) | KDM4ENPC1POLBHTTRAB9A | |
| SCHEMBL28620849 | 0.76 | NPC1 (0.60) | KDM4ENPC1POLBHTTRAB9A | |
| Saripidem SCHEMBL1061054 | 0.75 | GABRB2 (1.00) | KDM4ENPC1POLBHTTRAB9A |
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-2018015196-A1 | SUBSTITUTED DIAZAHETERO-BICYCLIC COMPOUNDS AND THEIR USE | BAYER AKTIENGESELLSCHAFT (DE) | 2018-01-25 | — | — | WO | disclosed |