Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRK1 | P41145 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | RAF1 | P04049 | 4/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MC4R | P32245 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | MC3R | P41968 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KDM6B | O15054 | 1/20 | 0.39 |
| ▸ | TET3 | O43151 | 1/20 | 0.39 |
| ▸ | KDM4A | O75164 | 1/20 | 0.39 |
| ▸ | BBOX1 | O75936 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | KDM5A | P29375 | 1/20 | 0.39 |
| ▸ | KDM5C | P41229 | 1/20 | 0.39 |
| ▸ | ASPH | Q12797 | 1/20 | 0.39 |
| ▸ | KDM4D | Q6B0I6 | 1/20 | 0.39 |
| ▸ | TET2 | Q6N021 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28292634 | 0.87 | MEN1 (0.52) | OPRK1KCNH2RAF1ADORA3TSHR | |
| SCHEMBL23488363 | 0.82 | PARP10 (0.55) | OPRK1KCNH2KDM4EALDH1A1MAPT | |
| SCHEMBL4348844 | 0.82 | OPRK1 (0.41) | OPRK1KCNH2RAF1ADORA3TSHR | |
| SCHEMBL2624147 | 0.80 | KDM4E (0.54) | OPRK1KCNH2KDM4E | |
| SCHEMBL4155509 | 0.79 | PARP10 (0.51) | OPRK1KCNH2RAF1BRAF | |
| SCHEMBL7447847 | 0.78 | NOS3 (0.55) | KDM4EALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL11206449 | 0.77 | OPRK1 (0.44) | OPRK1KCNH2RAF1ADORA3TSHR | |
| SCHEMBL30438262 | 0.77 | PARP10 (0.51) | OPRK1KCNH2RAF1TSHRKDM4E | |
| SCHEMBL11617771 | 0.77 | PARP10 (0.51) | OPRK1KCNH2RAF1TSHRKDM4E | |
| SCHEMBL2637576 | 0.77 | CCR1 (0.52) | KDM4EALDH1A1KDM6BTET3KDM4A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0728744-B1 | Process for the preparation of carboxylic acids of nitrogen-containing heterocycles | LONZA AG (CH) | 2002-04-10 | — | — | EP | disclosed |
| EP-0627422-B1 | Process for the preparation of carboxamides of nitrogen-containing aromatic heterocycles | LONZA AG (CH) | 1997-04-09 | — | — | EP | disclosed |
| EP-0728744-A2 | Process for the preparation of carboxylic acids of nitrogen-containing heterocycles | LONZA A.G. (CH) | 1996-08-28 | — | — | EP | disclosed |
| EP-0627422-A2 | Process for the preparation of carboxamides of nitrogen-containing aromatic heterocycles, as well as their use | LONZA A.G. (CH) | 1994-12-07 | — | — | EP | disclosed |