Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 2/20 | 0.45 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.43 |
| ▸ | MC4R | P32245 | 3/20 | 0.41 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.41 |
| ▸ | CHEK2 | O96017 | 2/20 | 0.40 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | HPGDS | O60760 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | SYK | P43405 | 1/20 | 0.38 |
| ▸ | ACSS2 | Q9NR19 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL762594 | 0.88 | TRPV3 (0.43) | SCN9ATRPV3MAPTTP53HPGDS | |
| SCHEMBL741679 | 0.88 | TRPV3 (0.41) | SCN9AUSP30CHEK2TRPV3HPGDS | |
| SCHEMBL741680 | 0.88 | TRPV3 (0.41) | SCN9AUSP30CHEK2TRPV3HPGDS | |
| SCHEMBL742013 | 0.88 | HTT (0.43) | CHEK2MAPTKCNH2CYP2D6HRH1 | |
| SCHEMBL742014 | 0.88 | HTT (0.43) | CHEK2MAPTKCNH2CYP2D6HRH1 | |
| SCHEMBL741974 | 0.86 | KCNH2 (0.52) | HPGDSKCNH2CYP2D6HRH1 | |
| SCHEMBL741975 | 0.86 | KCNH2 (0.52) | HPGDSKCNH2CYP2D6HRH1 | |
| SCHEMBL743901 | 0.86 | ADORA2A (0.48) | ADORA2ACHEK2MAPTKCNH2CYP2D6 | |
| SCHEMBL743900 | 0.86 | ADORA2A (0.48) | ADORA2ACHEK2MAPTKCNH2CYP2D6 | |
| SCHEMBL740324 | 0.84 | CYP2C9 (0.44) | SCN9AUSP30TRPV3HPGDSKCNH2 |
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-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 |
| US-8138168-B1 | Renin inhibitors | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-03-20 | — | — | US | disclosed |