Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CIT | O14578 | 1/20 | 0.30 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.30 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.30 |
| ▸ | RELA | Q04206 | 1/20 | 0.30 |
| ▸ | CTSC | P53634 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8779231 | 0.91 | CARM1 (0.33) | NFKB1NFKB2RELA | |
| SCHEMBL8779387 | 0.88 | AAK1 (0.38) | CIT | |
| SCHEMBL8779208 | 0.84 | HTT (0.38) | CIT | |
| SCHEMBL8779284 | 0.84 | NFKB1 (0.32) | NFKB1NFKB2RELA | |
| SCHEMBL8883021 | 0.83 | CIT (0.31) | CITNFKB1NFKB2RELA | |
| SCHEMBL8779292 | 0.81 | CARM1 (0.35) | — | |
| SCHEMBL8779176 | 0.80 | HPGD (0.38) | — | |
| SCHEMBL8779212 | 0.80 | HPGD (0.38) | — | |
| SCHEMBL8779418 | 0.78 | PPARG (0.36) | — | |
| SCHEMBL8779325 | 0.78 | IKBKB (0.37) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0661269-B1 | Substituted heterocyclic carboxylic acid amides, their preparation and their use as medicaments | HOECHST AG (DE) | 1997-03-26 | — | — | EP | disclosed |
| EP-0661269-A1 | Substituted heterocyclic carboxylic acid amides, their preparation and their use as medicaments | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-07-05 | — | — | EP | disclosed |