Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.40 |
| ▸ | AAK1 | Q2M2I8 | 5/20 | 0.38 |
| ▸ | ACACB | O00763 | 3/20 | 0.37 |
| ▸ | LNPEP | Q9UIQ6 | 2/20 | 0.37 |
| ▸ | CNR2 | P34972 | 6/20 | 0.36 |
| ▸ | GUCY1B2 | O75343 | 1/20 | 0.36 |
| ▸ | GUCY1A2 | P33402 | 1/20 | 0.36 |
| ▸ | GUCY1A1 | Q02108 | 1/20 | 0.36 |
| ▸ | GUCY1B1 | Q02153 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 3/20 | 0.35 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8779239 | 0.91 | LNPEP (0.40) | AAK1LNPEP | |
| SCHEMBL8779428 | 0.90 | IRAK4 (0.43) | IRAK4ACACB | |
| SCHEMBL8779191 | 0.89 | IRAK4 (0.38) | IRAK4ACACBGUCY1B2GUCY1A2GUCY1A1 | |
| SCHEMBL8779100 | 0.88 | LNPEP (0.42) | AAK1ACACBLNPEP | |
| SCHEMBL8779259 | 0.87 | IRAK4 (0.37) | IRAK4ACACBLNPEPCNR2CNR1 | |
| SCHEMBL8883026 | 0.85 | IRAK4 (0.41) | IRAK4AAK1LNPEPCNR2GUCY1B2 | |
| SCHEMBL8779223 | 0.82 | AAK1 (0.39) | AAK1 | |
| SCHEMBL8779225 | 0.81 | PARP15 (0.40) | IRAK4ACACBCNR2CNR1CCNA2 | |
| SCHEMBL8779243 | 0.81 | PPARG (0.38) | IRAK4ACACBLNPEP | |
| SCHEMBL8779387 | 0.81 | AAK1 (0.38) | AAK1 |
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 |