Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 4/20 | 0.34 |
| ▸ | HRH1 | P35367 | 3/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | ITGB2 | P05107 | 2/20 | 0.34 |
| ▸ | ICAM1 | P05362 | 2/20 | 0.34 |
| ▸ | ITGAL | P20701 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | DPP4 | P27487 | 3/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.33 |
| ▸ | CFD | P00746 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | OPRD1 | P41143 | 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 | |
|---|---|---|---|---|
| SCHEMBL738215 | 1.00 | KCNH2 (0.34) | KCNH2HRH1CYP2D6ITGB2ICAM1 | |
| SCHEMBL738214 | 1.00 | KCNH2 (0.34) | KCNH2HRH1CYP2D6ITGB2ICAM1 | |
| SCHEMBL739244 | 0.87 | HRH1 (0.46) | KCNH2HRH1CYP2D6CHRM1CYP3A4 | |
| SCHEMBL739245 | 0.87 | HRH1 (0.46) | KCNH2HRH1CYP2D6CHRM1CYP3A4 | |
| SCHEMBL738317 | 0.86 | HRH1 (0.39) | KCNH2HRH1CYP2D6CHRM1CYP3A4 | |
| SCHEMBL740604 | 0.86 | KCNH2 (0.43) | KCNH2HRH1CYP2D6ALDH1A1TSHR | |
| SCHEMBL740883 | 0.86 | KCNH2 (0.38) | KCNH2HRH1CYP2D6KMT2ADPP4 | |
| SCHEMBL740603 | 0.86 | KCNH2 (0.43) | KCNH2HRH1CYP2D6ALDH1A1TSHR | |
| SCHEMBL741263 | 0.86 | KCNH2 (0.38) | KCNH2HRH1CYP2D6KMT2ADPP4 | |
| SCHEMBL763717 | 0.85 | KCNH2 (0.36) | KCNH2HRH1CYP2D6ITGB2ICAM1 |
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 | claimed |
| US-8138168-B1 | Renin inhibitors | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-03-20 | — | — | US | disclosed |