Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 7/20 | 0.36 |
| ▸ | HRH1 | P35367 | 8/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | DPP4 | P27487 | 4/20 | 0.34 |
| ▸ | NMT2 | O60551 | 1/20 | 0.34 |
| ▸ | NMT1 | P30419 | 1/20 | 0.34 |
| ▸ | PROKR1 | Q8TCW9 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.33 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.33 |
| ▸ | ITGAL | P20701 | 1/20 | 0.33 |
| ▸ | DPP7 | Q9UHL4 | 3/20 | 0.33 |
| ▸ | DPP8 | Q6V1X1 | 2/20 | 0.33 |
| ▸ | DPP9 | Q86TI2 | 2/20 | 0.33 |
| ▸ | CFD | P00746 | 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 | |
|---|---|---|---|---|
| SCHEMBL739310 | 1.00 | KCNH2 (0.36) | KCNH2HRH1CYP2D6CYP3A4DPP4 | |
| SCHEMBL763717 | 1.00 | KCNH2 (0.36) | KCNH2HRH1CYP2D6CYP3A4DPP4 | |
| SCHEMBL742122 | 1.00 | KCNH2 (0.36) | KCNH2HRH1CYP2D6CYP3A4DPP4 | |
| SCHEMBL740856 | 0.92 | KCNH2 (0.36) | KCNH2HRH1CYP2D6CYP3A4NMT2 | |
| SCHEMBL763047 | 0.92 | KCNH2 (0.36) | KCNH2HRH1CYP2D6CYP3A4NMT2 | |
| SCHEMBL763176 | 0.92 | KCNH2 (0.36) | KCNH2HRH1CYP2D6CYP3A4NMT2 | |
| SCHEMBL741337 | 0.92 | KCNH2 (0.36) | KCNH2HRH1CYP2D6CYP3A4NMT2 | |
| SCHEMBL739863 | 0.90 | KCNH2 (0.35) | KCNH2HRH1CYP2D6CYP3A4PROKR1 | |
| SCHEMBL742135 | 0.89 | KCNH2 (0.39) | KCNH2HRH1CYP2D6CYP3A4DPP4 | |
| SCHEMBL742136 | 0.89 | KCNH2 (0.39) | KCNH2HRH1CYP2D6CYP3A4DPP4 |
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 |
|---|---|---|---|---|---|---|---|
| US-8138168-B1 | Renin inhibitors | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-03-20 | — | — | US | disclosed |
| US-8138168-B1 | Renin inhibitors | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-03-20 | — | — | US | disclosed |