Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.30 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8880853 | 0.93 | CYP1A2 (0.31) | CYP1A2CYP2C9 | |
| SCHEMBL8884367 | 0.90 | CYP1A2 (0.40) | CNR2CYP1A2CYP2C9LOXL2 | |
| SCHEMBL8883329 | 0.86 | KMT2A (0.42) | CYP1A2CYP2C9SCN9A | |
| SCHEMBL8882279 | 0.83 | MAPT (0.35) | CNR2SCN9A | |
| SCHEMBL8779207 | 0.81 | CARM1 (0.31) | — | |
| SCHEMBL8883715 | 0.81 | SMN1; SMN2 (0.37) | — | |
| SCHEMBL8884435 | 0.80 | TDP1 (0.42) | CYP1A2 | |
| SCHEMBL8884727 | 0.80 | MAOB (0.44) | — | |
| SCHEMBL8882459 | 0.79 | IKBKB (0.39) | — | |
| SCHEMBL8882392 | 0.79 | ALDH1A1 (0.39) | — |
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-5620995-A | Substituted heterocyclic carboxyamides, their preparation and their use as pharmaceuticals | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-04-15 | — | — | US | disclosed |