Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 9/20 | 0.38 |
| ▸ | NOS3 | P29474 | 1/20 | 0.37 |
| ▸ | NOS1 | P29475 | 1/20 | 0.37 |
| ▸ | NOS2 | P35228 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.33 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2778638 | 0.87 | TRPA1 (0.48) | TRPA1NOS3NOS1NOS2KDM4E | |
| SCHEMBL2866347 | 0.83 | MAOA (0.45) | TRPA1NOS3NOS1NOS2MAOA | |
| SCHEMBL11036381 | 0.80 | NOS3 (0.37) | TRPA1NOS3NOS1NOS2MAOA | |
| Potassium Ion SCHEMBL10910684 | 0.80 | NOS3 (0.37) | TRPA1NOS3NOS1NOS2MAOA | |
| SCHEMBL73322 | 0.80 | NOS3 (0.37) | TRPA1NOS3NOS1NOS2MAOA | |
| SCHEMBL2783069 | 0.79 | NOS3 (0.36) | TRPA1NOS3NOS1NOS2MAOA | |
| Hydrochloric Acid SCHEMBL11091871 | 0.75 | NOS3 (0.40) | TRPA1NOS3NOS1NOS2MAOA | |
| SCHEMBL11040814 | 0.75 | MAOA (0.39) | TRPA1NOS3NOS1NOS2MAOA | |
| SCHEMBL4145325 | 0.73 | NOS3 (0.42) | TRPA1NOS3NOS1NOS2MAOA | |
| Hydrochlorthiazide SCHEMBL11016184 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-2002187889-A | METHOD FOR PRODUCING OXYQUINOLINECARBOXYLIC ACID ANHYDRIDE | PERMACHEM ASIA LTD | 2002-07-05 | — | — | JP | disclosed |