Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 3/20 | 0.35 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.35 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.35 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.35 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.35 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.35 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.35 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.35 |
| ▸ | NAMPT | P43490 | 2/20 | 0.33 |
| ▸ | CNR2 | P34972 | 2/20 | 0.33 |
| ▸ | DRD2 | P14416 | 4/20 | 0.32 |
| ▸ | DRD3 | P35462 | 4/20 | 0.32 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.32 |
| ▸ | DRD4 | P21917 | 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 | |
|---|---|---|---|---|
| SCHEMBL5248284 | 0.92 | NPSR1 (0.37) | BRD4 | |
| SCHEMBL5246551 | 0.91 | RIPK1 (0.34) | PSEN1PSEN2APH1BNCSTNAPH1A | |
| SCHEMBL5246911 | 0.87 | NPC1 (0.45) | BRD4NAMPTDRD2DRD3 | |
| SCHEMBL5250280 | 0.84 | NPSR1 (0.36) | — | |
| SCHEMBL5246401 | 0.83 | BRD4 (0.41) | BRD4PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL5248058 | 0.83 | PRSS12 (0.36) | BRD4PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL5246426 | 0.82 | BRD4 (0.41) | BRD4PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL5244426 | 0.82 | DRD2 (0.37) | BRD4NAMPTDRD2DRD3SMPD1 | |
| SCHEMBL3113676 | 0.82 | ACKR3 (0.41) | BRD4CNR2 | |
| SCHEMBL5247626 | 0.81 | MIF (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-1867331-A1 | TRIAZOLE DERIVATIVE AND THE USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2007-12-19 | — | — | EP | disclosed |