Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 2/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | TRPV3 | Q8NET8 | 4/20 | 0.38 |
| ▸ | DAO | P14920 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.34 |
| ▸ | TKT | P29401 | 1/20 | 0.34 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.34 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.34 |
| ▸ | KCNQ4 | P56696 | 1/20 | 0.34 |
| ▸ | KCNQ5 | Q9NR82 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | CDK9 | P50750 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8511689 | 0.75 | DAO (0.42) | CYP2C9DAOCYP2C19CYP3A4CYP3A5 | |
| SCHEMBL9607440 | 0.75 | DAO (0.40) | CYP2C9TRPV3DAOCYP2C19CYP3A4 | |
| SCHEMBL9607438 | 0.74 | PDE2A (0.52) | PDE2APTGS1PTGS2 | |
| SCHEMBL12224816 | 0.73 | TRPV4 (0.44) | PDE2ATRPV3 | |
| SCHEMBL22585740 | 0.73 | TRPV4 (0.44) | PDE2ATRPV3 | |
| SCHEMBL12757500 | 0.73 | TRPV4 (0.44) | PDE2ATRPV3 | |
| SCHEMBL9607470 | 0.71 | DAO (0.43) | CYP2C9DAOCYP2C19CYP3A4CYP3A5 | |
| SCHEMBL18087799 | 0.70 | PDE2A (1.00) | PDE2ACYP2C9CYP2C19CYP3A4 | |
| SCHEMBL91511 | 0.68 | TRPV4 (0.52) | DAOCYP3A4CYP3A5TKTKCNQ3 | |
| SCHEMBL21503511 | 0.68 | TRPV4 (0.44) | TRPV3DAOCYP3A4CYP3A5TKT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012069856-A1 | ANTIMALARIAL COMPOUNDS | LIVERPOOL SCHOOL OF TROPICAL MEDICINE (GB) | 2012-05-31 | — | — | WO | disclosed |