Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMPD1 | P17405 | 5/20 | 0.35 |
| ▸ | TAS1R3 | Q7RTX0 | 3/20 | 0.34 |
| ▸ | TAS1R1 | Q7RTX1 | 3/20 | 0.34 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.34 |
| ▸ | NAMPT | P43490 | 3/20 | 0.34 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 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 | |
|---|---|---|---|---|
| SCHEMBL5244782 | 0.92 | SMPD1 (0.36) | SMPD1TAS1R3TAS1R1TAS1R2NAMPT | |
| SCHEMBL5246004 | 0.92 | TAS1R3 (0.34) | TAS1R3TAS1R1TAS1R2NAMPTPTGER4 | |
| SCHEMBL3117435 | 0.90 | SMPD1 (0.36) | SMPD1NOTUM | |
| SCHEMBL5244618 | 0.90 | TAS1R3 (0.33) | SMPD1TAS1R3TAS1R1TAS1R2NAMPT | |
| SCHEMBL3115558 | 0.87 | TP53 (0.41) | SMPD1TP53 | |
| SCHEMBL5244002 | 0.87 | SMPD1 (0.34) | SMPD1NOTUM | |
| SCHEMBL5244565 | 0.85 | NOTUM (0.35) | SMPD1PTGER4NOTUM | |
| SCHEMBL3113668 | 0.85 | NOTUM (0.39) | SMPD1NOTUM | |
| SCHEMBL3115101 | 0.84 | SMPD1 (0.43) | SMPD1NOTUM | |
| SCHEMBL3114843 | 0.84 | NOTUM (0.40) | SMPD1NOTUM |
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-1867331-A1 | TRIAZOLE DERIVATIVE AND THE USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2007-12-19 | — | — | EP | disclosed |