Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 9/20 | 0.73 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.50 |
| ▸ | F2RL3 | Q96RI0 | 1/20 | 0.49 |
| ▸ | TACR1 | P25103 | 4/20 | 0.48 |
| ▸ | MAPK8 | P45983 | 4/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8787724 | 0.85 | DPP4 (0.77) | DPP4KCNA5KCNH2F2RL3TACR1 | |
| SCHEMBL5232770 | 0.85 | DPP4 (1.00) | DPP4KCNA5KCNH2TACR1 | |
| SCHEMBL8785047 | 0.84 | DPP4 (0.72) | DPP4KCNA5KCNH2TACR1MAPK8 | |
| SCHEMBL4685943 | 0.83 | KCNA5 (0.73) | DPP4KCNA5KCNH2F2RL3TACR1 | |
| SCHEMBL8784994 | 0.82 | DPP4 (0.73) | DPP4KCNA5KCNH2TACR1MAPK8 | |
| SCHEMBL8947899 | 0.82 | DPP4 (1.00) | DPP4KCNA5KCNH2TACR1MAPK8 | |
| SCHEMBL8947984 | 0.82 | DPP4 (0.53) | DPP4TACR1MAPK8 | |
| Hydrochloric Acid SCHEMBL8947929 | 0.81 | DPP4 (0.52) | DPP4TACR1MAPK8 | |
| SCHEMBL5236714 | 0.81 | DPP4 (0.70) | DPP4KCNA5KCNH2TACR1 | |
| SCHEMBL5237066 | 0.80 | DPP4 (0.56) | DPP4KCNA5KCNH2TACR1MAPK8 |
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 |
|---|---|---|---|---|---|---|---|
| US-5527811-A | CALCIUM- AND SUBSTANCE P RECEPTOR-ANTAGONIST ACTIVITY | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1996-06-18 | — | — | US | claimed |
| US-5527811-A | CALCIUM- AND SUBSTANCE P RECEPTOR-ANTAGONIST ACTIVITY | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1996-06-18 | — | — | US | disclosed |
| EP-0634402-A1 | Isochinolinone derivatives, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1995-01-18 | — | — | EP | disclosed |