Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 4/20 | 0.35 |
| ▸ | TACR1 | P25103 | 2/20 | 0.35 |
| ▸ | HRH1 | P35367 | 3/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.34 |
| ▸ | TSHR | P16473 | 5/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | MCHR1 | Q99705 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL739863 | 0.92 | KCNH2 (0.35) | KCNH2TACR1HRH1CYP2D6ALDH1A1 | |
| SCHEMBL740059 | 0.92 | CTSB (0.35) | KCNH2TACR1HRH1CYP2D6CYP3A4 | |
| SCHEMBL762621 | 0.92 | CTSB (0.35) | KCNH2TACR1HRH1CYP2D6CYP3A4 | |
| SCHEMBL740058 | 0.92 | CTSB (0.35) | KCNH2TACR1HRH1CYP2D6CYP3A4 | |
| SCHEMBL741337 | 0.90 | KCNH2 (0.36) | KCNH2HRH1CYP2D6ALDH1A1TSHR | |
| SCHEMBL763176 | 0.90 | KCNH2 (0.36) | KCNH2HRH1CYP2D6ALDH1A1TSHR | |
| SCHEMBL763047 | 0.90 | KCNH2 (0.36) | KCNH2HRH1CYP2D6ALDH1A1TSHR | |
| SCHEMBL740856 | 0.90 | KCNH2 (0.36) | KCNH2HRH1CYP2D6ALDH1A1TSHR | |
| SCHEMBL739252 | 0.88 | KCNH2 (0.41) | KCNH2HRH1CYP2D6ALDH1A1TSHR | |
| SCHEMBL739901 | 0.88 | HRH1 (0.46) | KCNH2HRH1CYP2D6CHRM1CYP3A4 |
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 1 patent. 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 |