Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 5/20 | 0.36 |
| ▸ | DRD3 | P35462 | 5/20 | 0.36 |
| ▸ | DRD4 | P21917 | 1/20 | 0.35 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | NAMPT | P43490 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5244426 | 0.91 | DRD2 (0.37) | DRD2DRD3DRD4ACKR3NPC1 | |
| SCHEMBL3102931 | 0.90 | TP53 (0.39) | DRD2DRD3DRD4NPC1RAB9A | |
| SCHEMBL3104911 | 0.90 | S1PR1 (0.41) | DRD2DRD3DRD4S1PR1SMPD1 | |
| SCHEMBL5245310 | 0.85 | DRD2 (0.38) | DRD2DRD3DRD4 | |
| SCHEMBL5250335 | 0.85 | SMN1; SMN2 (0.45) | DRD2DRD3NPC1MEN1KMT2A | |
| SCHEMBL3109192 | 0.85 | ACKR3 (0.40) | DRD2DRD3ACKR3 | |
| SCHEMBL5246678 | 0.84 | SMPD1 (0.39) | DRD2DRD3DRD4ACKR3S1PR1 | |
| SCHEMBL5244453 | 0.84 | KMT2A (0.41) | NPC1RAB9AMEN1KMT2ANAMPT | |
| SCHEMBL5246003 | 0.83 | SMPD1 (0.37) | DRD2DRD3DRD4S1PR1SMPD1 | |
| SCHEMBL5246041 | 0.83 | MIF (0.45) | DRD2DRD3 |
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 |