Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 9/20 | 0.44 |
| ▸ | HRH1 | P35367 | 11/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | PADI4 | Q9UM07 | 1/20 | 0.39 |
| ▸ | RXRA | P19793 | 1/20 | 0.39 |
| ▸ | RXRB | P28702 | 1/20 | 0.39 |
| ▸ | RXRG | P48443 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL763429 | 0.89 | KCNH2 (0.42) | KCNH2HRH1CYP2D6CHRM1USP2 | |
| SCHEMBL763858 | 0.89 | KCNH2 (0.42) | KCNH2HRH1CYP2D6CHRM1USP2 | |
| SCHEMBL763178 | 0.89 | HRH1 (0.43) | KCNH2HRH1CYP2D6CHRM1 | |
| SCHEMBL763880 | 0.89 | HRH1 (0.43) | KCNH2HRH1CYP2D6CHRM1 | |
| SCHEMBL762674 | 0.89 | HRH1 (0.41) | KCNH2HRH1CYP2D6CHRM1USP2 | |
| SCHEMBL762785 | 0.89 | HRH1 (0.42) | KCNH2HRH1CYP2D6CHRM1PADI4 | |
| SCHEMBL762673 | 0.88 | HRH1 (0.41) | KCNH2HRH1CYP2D6CHRM1USP2 | |
| SCHEMBL10292651 | 0.88 | HRH1 (0.44) | KCNH2HRH1CYP2D6CHRM1 | |
| SCHEMBL765309 | 0.88 | HRH1 (0.39) | KCNH2HRH1CYP2D6CHRM1PADI4 | |
| SCHEMBL16301221 | 0.88 | HRH1 (0.40) | KCNH2HRH1CYP2D6CHRM1 |
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 |