Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 2/20 | 0.50 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.50 |
| ▸ | RAF1 | P04049 | 4/20 | 0.47 |
| ▸ | BRAF | P15056 | 1/20 | 0.46 |
| ▸ | MGLL | Q99685 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | LYN | P07948 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | GRM5 | P41594 | 1/20 | 0.42 |
| ▸ | GCK | P35557 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6014158 | 0.86 | RAF1 (0.54) | HSD17B1HSD17B2RAF1BRAFMGLL | |
| SCHEMBL9926359 | 0.84 | LMNA (0.50) | HSD17B1HSD17B2ALDH1A1LYNLMNA | |
| SCHEMBL257972 | 0.83 | MAPT (0.48) | RAF1BRAFALDH1A1LYNLMNA | |
| SCHEMBL24310884 | 0.82 | KDR (0.48) | ALDH1A1LYNGRM5GCKMAPT | |
| SCHEMBL170881 | 0.81 | ALDH1A1 (0.45) | HSD17B1HSD17B2ALDH1A1LYNLMNA | |
| SCHEMBL167783 | 0.81 | KDR (0.58) | RAF1BRAFALDH1A1LYN | |
| SCHEMBL9926365 | 0.80 | ALDH1A1 (0.44) | HSD17B1HSD17B2ALDH1A1LYNLMNA | |
| SCHEMBL620695 | 0.79 | RAF1 (0.53) | RAF1BRAFALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL4947098 | 0.78 | ALDH1A1 (0.44) | RAF1ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL18780870 | 0.76 | RAF1 (0.48) | HSD17B1HSD17B2RAF1BRAFALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2426122-A1 | Methylene urea derivative as RAF kinasse inhibitors | Merck Patent GmbH (DE) | 2012-03-07 | — | — | EP | disclosed |
| EP-1158985-B1 | OMEGA-CARBOXY ARYL SUBSTITUTED DIPHENYL UREAS AS p38 KINASE INHIBITORS | BAYER HEALTHCARE LLC (US) | 2011-12-28 | — | — | EP | disclosed |