Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 3/20 | 0.41 |
| ▸ | GRM5 | P41594 | 1/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.37 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.37 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.37 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.37 |
| ▸ | ACHE | P22303 | 2/20 | 0.36 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.36 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.35 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.35 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5238925 | 0.84 | GABRA1 (0.42) | DPP4GABRA1GABRG2GABRB3GABRA5 | |
| SCHEMBL5233021 | 0.83 | DPP4 (0.44) | DPP4GRM5GABRA1GABRG2GABRB3 | |
| SCHEMBL7558991 | 0.83 | DPP4 (0.51) | DPP4GABRA1GABRG2GABRB3GABRA5 | |
| SCHEMBL5235752 | 0.83 | GABRA1 (0.43) | DPP4GABRA1GABRG2GABRB3GABRA5 | |
| SCHEMBL5232739 | 0.82 | DPP4 (0.47) | DPP4GRM5GABRA1GABRG2GABRB3 | |
| Hydrochloric Acid SCHEMBL5234681 | 0.82 | DPP4 (0.50) | DPP4GABRA1GABRG2GABRB3GABRA5 | |
| SCHEMBL5238403 | 0.80 | DPP4 (0.45) | DPP4GABRA1GABRG2GABRB3GABRA5 | |
| SCHEMBL5237934 | 0.80 | DPP4 (0.45) | DPP4GABRA1GABRG2GABRB3GABRA5 | |
| SCHEMBL5236241 | 0.78 | PDE10A (0.46) | DPP4GRM5GABRA1GABRG2GABRB3 | |
| SCHEMBL5239292 | 0.78 | DPP4 (0.40) | DPP4GRM5GABRA1GABRG2GABRB3 |
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-B1 | FUSED HETEROCYCLIC COMPOUNDS | TAKEDA PHARMACEUTICAL (JP) | 2007-07-11 | — | — | EP | disclosed |
| US-7034039-B2 | Fused heterocyclic compounds | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2006-04-25 | — | — | US | disclosed |
| WO-2002062764-A9 | FUSED HETEROCYCLIC COMPOUNDS | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2002-10-10 | — | — | WO | disclosed |