Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 11/20 | 0.68 |
| ▸ | MAPT | P10636 | 5/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.56 |
| ▸ | ATM | Q13315 | 3/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | PPARG | P37231 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 2/20 | 0.51 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.47 |
| ▸ | NPY1R | P25929 | 1/20 | 0.46 |
| ▸ | NPY2R | P49146 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL16585308 | 0.87 | KDM4E (0.72) | KDM4EMAPTALDH1A1TDP1LMNA | |
| SCHEMBL21596090 | 0.87 | KDM4E (0.56) | KDM4EMAPTMAPK1ALDH1A1TDP1 | |
| SCHEMBL21595725 | 0.85 | KDM4E (0.54) | KDM4EMAPTMAPK1ATMALDH1A1 | |
| SCHEMBL21595734 | 0.84 | KDM4E (0.51) | KDM4EMAPTMAPK1ATMALDH1A1 | |
| SCHEMBL21601488 | 0.83 | KDM4E (0.55) | KDM4EMAPTMAPK1ATMALDH1A1 | |
| SCHEMBL10828209 | 0.81 | KDM4E (0.49) | KDM4EMAPTMAPK1ATMALDH1A1 | |
| SCHEMBL9158338 | 0.80 | LTA4H (0.53) | KDM4EMAPTMAPK1ATMALDH1A1 | |
| SCHEMBL21595706 | 0.80 | KDM4E (0.56) | KDM4EMAPK1ALDH1A1TDP1GAA | |
| SCHEMBL10359783 | 0.79 | PPARG (0.67) | KDM4EMAPTMAPK1ATMALDH1A1 | |
| SCHEMBL15445592 | 0.79 | TSHR (0.71) | KDM4EMAPTMAPK1ATMALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019244066-A2 | PYRIDIN-3-YL ACETIC ACID DERIVATIVES AS INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION | VIIV Healthcare UK (No.5) Limited (GB) | 2019-12-26 | — | — | WO | disclosed |