Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | PKM | P14618 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | SCD | O00767 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | AGPAT2 | O15120 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1708081 | 0.94 | SCD (0.36) | NPC1RAB9AMAPTPKMGAA | |
| SCHEMBL1708150 | 0.91 | NPC1 (0.39) | NPC1RAB9ATP53SMN1; SMN2MAPT | |
| SCHEMBL1708093 | 0.90 | NPC1 (0.38) | NPC1RAB9ATP53SMN1; SMN2MAPT | |
| SCHEMBL1708080 | 0.86 | NPC1 (0.35) | NPC1RAB9ATP53SMN1; SMN2MAPT | |
| SCHEMBL1708106 | 0.86 | NPC1 (0.35) | NPC1RAB9ATP53SMN1; SMN2MAPT | |
| SCHEMBL1708613 | 0.85 | ALDH1A1 (0.34) | NPC1RAB9ATP53MAPTGAA | |
| SCHEMBL1708133 | 0.85 | GFER (0.36) | NPC1RAB9ATP53SMN1; SMN2MAPT | |
| SCHEMBL1708139 | 0.84 | GFER (0.39) | NPC1RAB9ATP53SMN1; SMN2MAPT | |
| SCHEMBL1708244 | 0.84 | NPC1 (0.32) | NPC1RAB9AMAPTALDH1A1LMNA | |
| SCHEMBL1708634 | 0.83 | TP53 (0.35) | NPC1RAB9ATP53SMN1; SMN2MAPT |
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-2440541-A1 | NOVEL FUSED CYCLIC COMPOUND AND USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2012-04-18 | — | — | EP | disclosed |
| WO-2010143733-A1 | NOVEL FUSED CYCLIC COMPOUND AND USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2010-12-16 | — | — | WO | disclosed |