Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK2 | O60674 | 1/20 | 0.43 |
| ▸ | BTK | Q06187 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | GSK3A | P49840 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | MGLL | Q99685 | 2/20 | 0.37 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HCAR1 | Q9BXC0 | 3/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | WNT3A | P56704 | 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 | |
|---|---|---|---|---|
| SCHEMBL10473916 | 0.91 | JAK2 (0.40) | JAK2BTKOPRM1ALDH1A1SMN1; SMN2 | |
| SCHEMBL10474202 | 0.82 | HSD11B1 (0.43) | KCNN4ALDH1A1HCAR1L3MBTL1 | |
| SCHEMBL7652883 | 0.80 | OPRM1 (0.41) | OPRM1GSK3AGSK3BMGLLALDH1A1 | |
| SCHEMBL10475264 | 0.80 | HCAR1 (0.39) | JAK2BTKALDH1A1SMN1; SMN2HCAR1 | |
| SCHEMBL10474070 | 0.76 | CDK4 (0.38) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL7658070 | 0.74 | NPC1 (0.44) | MGLLALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL10475265 | 0.72 | MAPT (0.38) | ALDH1A1L3MBTL1 | |
| SCHEMBL10475053 | 0.71 | OPRM1 (0.36) | JAK2BTKOPRM1MGLLKCNN4 | |
| SCHEMBL10475378 | 0.71 | GAA (0.46) | ALDH1A1L3MBTL1 | |
| SCHEMBL30582372 | 0.69 | DHODH (0.40) | OPRM1GSK3AGSK3BMGLLALDH1A1 |
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-4943583-A | PESTICIDES | HOFFMANN-LA ROCHE INC. (US) | 1990-07-24 | — | — | US | disclosed |
| EP-0270061-A2 | Five-membered heterocycles with three heteroatoms, their preparation and their use as pesticides | CIBA-GEIGY AG (CH) | 1988-06-08 | — | — | EP | disclosed |