Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | JAK2 | O60674 | 3/20 | 0.36 |
| ▸ | JAK1 | P23458 | 3/20 | 0.36 |
| ▸ | TYK2 | P29597 | 3/20 | 0.36 |
| ▸ | JAK3 | P52333 | 3/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | BCHE | P06276 | 2/20 | 0.35 |
| ▸ | ACHE | P22303 | 2/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9412444 | 0.87 | HDAC6 (0.45) | CNR2JAK2JAK1TYK2JAK3 | |
| Bromide SCHEMBL9412526 | 0.87 | HDAC6 (0.44) | CNR2JAK2JAK1TYK2JAK3 | |
| SCHEMBL9412565 | 0.82 | FAAH (0.45) | BCHEACHEHDAC6NPC1RAB9A | |
| SCHEMBL9412511 | 0.79 | MAPT (0.45) | BRD4NPC1RAB9ASMN1; SMN2LMNA | |
| SCHEMBL9412623 | 0.77 | MAPT (0.46) | BRD4HDAC6NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL9412664 | 0.77 | PDE3B (0.42) | CNR2HDAC6ALDH1A1KDM4ENPC1 | |
| SCHEMBL9412612 | 0.77 | ITGB3 (0.42) | CNR2BRD4BCHEHDAC6ALDH1A1 | |
| SCHEMBL9412557 | 0.76 | MAPT (0.41) | CNR2BRD4HDAC6MEN1KMT2A | |
| SCHEMBL9188544 | 0.75 | ITGB3 (0.57) | — | |
| Bromide SCHEMBL9412462 | 0.74 | ITGB3 (0.56) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0611660-A2 | Condensed 5-membered heterocycles, process for their preparation and medicines containing these compounds | Dr. Karl Thomae GmbH (DE) | 1994-08-24 | — | — | EP | disclosed |