Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 6/20 | 0.54 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | TACR1 | P25103 | 2/20 | 0.44 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA3 | P07451 | 1/20 | 0.43 |
| ▸ | CA4 | P22748 | 1/20 | 0.43 |
| ▸ | CA6 | P23280 | 1/20 | 0.43 |
| ▸ | CA5A | P35218 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.43 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.43 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.42 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5235258 | 0.89 | DPP4 (0.53) | DPP4KCNA5KCNH2TACR1MAPK8 | |
| SCHEMBL5237229 | 0.87 | DPP4 (0.56) | DPP4CYP3A4TACR1 | |
| SCHEMBL5240310 | 0.85 | DPP4 (0.57) | DPP4KCNA5KCNH2CYP3A4CA1 | |
| SCHEMBL5238106 | 0.84 | DPP4 (0.53) | DPP4TACR1 | |
| SCHEMBL5238796 | 0.83 | DPP4 (0.58) | DPP4KCNA5KCNH2CYP3A4CA1 | |
| SCHEMBL7006788 | 0.82 | DPP4 (0.74) | DPP4KCNA5KCNH2CYP3A4CA1 | |
| Hydrochloric Acid SCHEMBL5240250 | 0.81 | DPP4 (0.72) | DPP4KCNA5KCNH2CYP3A4CA1 | |
| SCHEMBL5233643 | 0.81 | DPP4 (0.59) | DPP4KCNA5KCNH2TACR1MAPK8 | |
| SCHEMBL5237066 | 0.81 | DPP4 (0.56) | DPP4KCNA5KCNH2TACR1MAPK8 | |
| SCHEMBL6110261 | 0.81 | KCNA5 (0.53) | DPP4KCNA5KCNH2CYP3A4TACR1 |
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 2 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-A1 | FUSED HETEROCYCLIC COMPOUNDS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2002-08-15 | — | — | WO | disclosed |