Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | ACACB | O00763 | 1/20 | 0.33 |
| ▸ | GCG | P01275 | 1/20 | 0.33 |
| ▸ | PPARD | Q03181 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2669782 | 0.89 | EGFR (0.36) | NPC1GCGPPARDRAB9AKMT2A | |
| SCHEMBL2669958 | 0.88 | CASP3 (0.39) | NPC1RAB9AKMT2A | |
| SCHEMBL2669819 | 0.88 | CYP4F2 (0.36) | NPC1GCGRAB9A | |
| SCHEMBL2669939 | 0.87 | NPC1 (0.39) | NPC1RAB9A | |
| SCHEMBL13069673 | 0.86 | CYP4F2 (0.36) | NPC1GCGRAB9A | |
| SCHEMBL9070786 | 0.86 | NPC1 (0.37) | NPC1RAB9A | |
| SCHEMBL2669833 | 0.85 | CYP4F2 (0.39) | GCG | |
| SCHEMBL2669904 | 0.85 | CYP4F2 (0.34) | NPC1GCGRAB9AKMT2A | |
| SCHEMBL2669842 | 0.85 | NPC1 (0.33) | NPC1RAB9AKMT2A | |
| SCHEMBL2669955 | 0.85 | ESR1 (0.39) | NPC1RAB9A |
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-2009110520-A1 | HETEROCYCLIC COMPOUND | 武田薬品工業株式会社 (JP) | 2009-09-11 | — | — | WO | disclosed |