Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 12/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | PDE2A | O00408 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.32 |
| ▸ | PDE1A | P54750 | 1/20 | 0.32 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.32 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.32 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.32 |
| ▸ | RXFP1 | Q9HBX9 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5236063 | 0.99 | DPP4 (0.39) | DPP4ALDH1A1LMNAHTTPDE2A | |
| SCHEMBL5238966 | 0.90 | ALDH1A1 (0.37) | DPP4ALDH1A1LMNAHTTPDE2A | |
| SCHEMBL5238974 | 0.89 | ALDH1A1 (0.36) | DPP4ALDH1A1LMNAHTTPDE2A | |
| Hydrochloric Acid SCHEMBL5232890 | 0.89 | DPP4 (0.44) | DPP4 | |
| SCHEMBL5236184 | 0.86 | DPP4 (0.43) | DPP4 | |
| Hydrochloric Acid SCHEMBL5234754 | 0.85 | DPP4 (0.43) | DPP4 | |
| Hydrochloric Acid SCHEMBL5237461 | 0.85 | ALDH1A1 (0.46) | DPP4ALDH1A1HTTADORA2AADORA2B | |
| SCHEMBL5238212 | 0.83 | RXFP1 (0.34) | ALDH1A1MAPTRXFP1 | |
| Hydrochloric Acid SCHEMBL5239739 | 0.82 | HPGD (0.39) | DPP4ALDH1A1LMNAHTTMEN1 | |
| SCHEMBL5276978 | 0.82 | TSHR (0.40) | ALDH1A1HTTMAPTNPSR1RXFP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1355886-A1 | FUSED HETEROCYCLIC COMPOUNDS | Takeda Chemical Industries, Ltd. (JP) | 2003-10-29 | — | — | EP | disclosed |
| WO-2002062764-A9 | FUSED HETEROCYCLIC COMPOUNDS | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2002-10-10 | — | — | WO | disclosed |
| WO-2002062764-A1 | FUSED HETEROCYCLIC COMPOUNDS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2002-08-15 | — | — | WO | disclosed |