Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | NAMPT | P43490 | 1/20 | 0.36 |
| ▸ | SYK | P43405 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | CASP7 | P55210 | 1/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | CCNC | P24863 | 1/20 | 0.32 |
| ▸ | CDK8 | P49336 | 1/20 | 0.32 |
| ▸ | RAPGEF3 | O95398 | 1/20 | 0.32 |
| ▸ | ELANE | P08246 | 1/20 | 0.32 |
| ▸ | HSD17B14 | Q9BPX1 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16061977 | 0.91 | CCNC (0.40) | NAMPTHPGDKDM4EALDH1A1GAA | |
| SCHEMBL23587032 | 0.83 | CYP2A6 (0.42) | CYP2A6NAMPTHSD17B10HPGDALDH1A1 | |
| SCHEMBL16092088 | 0.76 | CDC25B (0.43) | HPGDKDM4EALDH1A1SMN1; SMN2L3MBTL1 | |
| SCHEMBL5847575 | 0.73 | SMN1; SMN2 (0.46) | NAMPTHPGDKDM4EALDH1A1GAA | |
| SCHEMBL14523452 | 0.69 | MAPT (0.42) | KDM4EALDH1A1CASP1SMN1; SMN2NPC1 | |
| SCHEMBL4672007 | 0.68 | LTA4H (0.42) | NAMPTNPC1MAPT | |
| SCHEMBL26933366 | 0.66 | ROCK2 (0.37) | NAMPTHSD17B10HPGDKDM4EALDH1A1 | |
| SCHEMBL15704203 | 0.66 | CYP2A6 (0.61) | CYP2A6HSD17B10HPGDKDM4EALDH1A1 | |
| SCHEMBL12600053 | 0.65 | HDAC3 (0.48) | NAMPTKDM4EALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL17736033 | 0.65 | SLC6A2 (0.47) | HPGDKDM4EALDH1A1GAAALOX15 |
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-3842424-A1 | MAP KINASE MODULATORS AND USES THEREOF IN THE TRETAMENT OF TAUOPATHIES | The Trustees of Columbia University in the City of New York (US) | 2021-06-30 | — | — | EP | disclosed |
| EP-3521284-A1 | PYRAZINE COMPOUNDS AS MAP KINASE MODULATORS AND USES THEREOF | The Trustees of Columbia University in the City of New York (US) | 2019-08-07 | — | — | EP | disclosed |