Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | HRH1 | P35367 | 6/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7861738 | 0.82 | KCNH2 (0.43) | IRAK4HRH1KDM4E | |
| SCHEMBL7861741 | 0.82 | KCNH2 (0.43) | IRAK4HRH1KDM4E | |
| SCHEMBL7861486 | 0.78 | TACR1 (0.45) | IRAK4OPRM1OPRD1OPRK1HRH1 | |
| SCHEMBL7861479 | 0.78 | TACR1 (0.45) | IRAK4OPRM1OPRD1OPRK1HRH1 | |
| SCHEMBL7861794 | 0.78 | TACR1 (0.45) | IRAK4OPRM1OPRD1OPRK1HRH1 | |
| SCHEMBL7861484 | 0.78 | TACR1 (0.45) | IRAK4OPRM1OPRD1OPRK1HRH1 | |
| SCHEMBL7861787 | 0.78 | TACR1 (0.45) | IRAK4OPRM1OPRD1OPRK1HRH1 | |
| Oxalic Acid SCHEMBL7864912 | 0.74 | HRH1 (0.45) | IRAK4HRH1KDM4E | |
| Oxalic Acid SCHEMBL7864914 | 0.74 | HRH1 (0.45) | IRAK4HRH1KDM4E | |
| SCHEMBL7854951 | 0.72 | KDM4E (0.45) | HRH1KDM4ETSHR |
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-0869955-A1 | N-ACYL-2-SUBSTITUTED-4-(BENZIMIDAZOLYL- OR IMIDAZOPYRIDINYL-SUBSTITUTED RESIDUES)-PIPERIDINES AS TACHYKININ ANTAGONISTS | JANSSEN PHARMACEUTICA N.V. (BE) | 1998-10-14 | — | — | EP | disclosed |
| WO-1997024350-A1 | N-ACYL-2-SUBSTITUTED-4-(BENZIMIDAZOLYL- OR IMIDAZOPYRIDINYL-SUBSTITUTED RESIDUES)-PIPERIDINES AS TACHYKININ ANTAGONISTS | JANSSEN PHARMACEUTICA N.V. (BE) | 1997-07-10 | — | — | WO | disclosed |