Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 2/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.53 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | KCNK3 | O14649 | 2/20 | 0.52 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.52 |
| ▸ | BRAF | P15056 | 6/20 | 0.52 |
| ▸ | CSF1R | P07333 | 4/20 | 0.52 |
| ▸ | KIT | P10721 | 2/20 | 0.52 |
| ▸ | LCK | P06239 | 2/20 | 0.52 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.52 |
| ▸ | KDR | P35968 | 1/20 | 0.52 |
| ▸ | BTK | Q06187 | 1/20 | 0.52 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.51 |
| ▸ | ABL1 | P00519 | 1/20 | 0.51 |
| ▸ | SRC | P12931 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL15122844 | 0.90 | HDAC8 (0.66) | RAB9ANPC1SMN1; SMN2HDAC8HDAC6 | |
| SCHEMBL2497760 | 0.89 | MEN1 (0.68) | RAB9AMEN1HTTKMT2AKCNK3 | |
| SCHEMBL10092868 | 0.86 | CSF1R (0.55) | RAB9AHDAC8HDAC6MEN1HTT | |
| SCHEMBL13736827 | 0.84 | BRAF (0.65) | BRAF | |
| SCHEMBL13837913 | 0.83 | CSF1R (0.53) | RAB9AHDAC8HDAC6MEN1HTT | |
| SCHEMBL12065276 | 0.82 | LCK (0.55) | RAB9AMEN1HTTKMT2ABRAF | |
| SCHEMBL3933740 | 0.79 | MAPT (0.68) | RAB9AMEN1HTTKMT2AKCNK3 | |
| SCHEMBL30523366 | 0.79 | MAPT (0.68) | RAB9AMEN1HTTKMT2AKCNK3 | |
| SCHEMBL24629178 | 0.78 | NPC1 (0.57) | RAB9ANPC1SMN1; SMN2HDAC8MEN1 | |
| SCHEMBL12136759 | 0.77 | KCNK3 (0.70) | RAB9ANPC1SMN1; SMN2HDAC8HDAC6 |
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-2012148792-A1 | HETEROCYCLIC COMPOUNDS AS B-RAF INHIBITORS FOR TREATMENT OF CANCER | MERCK SHARP & DOHME CORP. (US) | 2012-11-01 | — | — | WO | disclosed |