Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 17/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL8181093 | 0.77 | MMP1 (0.56) | NPC1RAB9A | |
| SCHEMBL8181099 | 0.77 | MMP1 (0.56) | NPC1RAB9A | |
| SCHEMBL21506065 | 0.77 | CCNC (0.56) | NPC1RAB9A | |
| SCHEMBL18492006 | 0.76 | CCNC (0.66) | — | |
| SCHEMBL21506047 | 0.76 | CCNC (0.41) | NPC1RAB9A | |
| SCHEMBL18492008 | 0.76 | CCNC (0.66) | — | |
| Hydrochloric Acid SCHEMBL18491704 | 0.76 | CCNC (0.65) | — | |
| Hydrochloric Acid SCHEMBL18491701 | 0.76 | CCNC (0.65) | — | |
| SCHEMBL29186150 | 0.74 | NAMPT (0.67) | NAMPTNPC1RAB9A | |
| SCHEMBL30138320 | 0.74 | ACVR1 (0.48) | — |
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-3205645-A1 | HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2017-08-16 | — | — | EP | disclosed |