Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 3/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 2/20 | 0.39 |
| ▸ | WEE1 | P30291 | 1/20 | 0.38 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | RAF1 | P04049 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL20264488 | 0.81 | RAF1 (0.44) | CNR2HTTHSD11B1ALDH1A1NPSR1 | |
| SCHEMBL6927953 | 0.68 | HTT (0.51) | HTTALDH1A1NPSR1MEN1KMT2A | |
| SCHEMBL29387269 | 0.67 | POLB (0.45) | CNR2HTTHSD11B1ALDH1A1NPSR1 | |
| SCHEMBL22864157 | 0.66 | MTOR (0.37) | — | |
| SCHEMBL14376077 | 0.66 | TP53 (0.44) | HTTALDH1A1NPSR1MEN1KMT2A | |
| SCHEMBL29208696 | 0.66 | KDR (0.39) | EGFR | |
| SCHEMBL19144983 | 0.66 | CNR2 (0.47) | CNR2HSD11B1ALDH1A1MEN1KMT2A | |
| SCHEMBL14922274 | 0.66 | CYP1A2 (0.47) | CNR2ALDH1A1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL28976260 | 0.66 | SMN1; SMN2 (0.47) | CNR2ALDH1A1TRPV1MEN1KMT2A | |
| SCHEMBL14376003 | 0.66 | TP53 (0.42) | HTTALDH1A1NPSR1MEN1KMT2A |
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-3191478-B1 | COMPOUNDS AND COMPOSITIONS AS RAF KINASE INHIBITORS | NOVARTIS AG (CH) | 2019-05-08 | — | — | EP | disclosed |