Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.76 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.76 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.63 |
| ▸ | HPGD | P15428 | 2/20 | 0.63 |
| ▸ | HTR7 | P34969 | 2/20 | 0.63 |
| ▸ | HTR1A | P08908 | 1/20 | 0.63 |
| ▸ | DRD2 | P14416 | 1/20 | 0.63 |
| ▸ | HTR2A | P28223 | 1/20 | 0.63 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.60 |
| ▸ | ATM | Q13315 | 1/20 | 0.60 |
| ▸ | NPC1 | O15118 | 1/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | RAB9A | P51151 | 1/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL7925646 | 0.89 | ALDH1A1 (0.73) | ALDH1A1KDM4ESMN1; SMN2HPGDHTR7 | |
| SCHEMBL7925644 | 0.89 | ALDH1A1 (0.73) | ALDH1A1KDM4ESMN1; SMN2HPGDHTR7 | |
| SCHEMBL8088614 | 0.89 | ALDH1A1 (0.75) | ALDH1A1KDM4ESMN1; SMN2HPGDL3MBTL1 | |
| SCHEMBL15630725 | 0.85 | ALDH1A1 (0.81) | ALDH1A1KDM4ESMN1; SMN2HPGDL3MBTL1 | |
| SCHEMBL8909943 | 0.84 | ALDH1A1 (0.66) | ALDH1A1KDM4ESMN1; SMN2HTR7HTR1A | |
| SCHEMBL8909936 | 0.84 | ALDH1A1 (0.66) | ALDH1A1KDM4ESMN1; SMN2HTR7HTR1A | |
| Hydrochloric Acid SCHEMBL10966191 | 0.83 | — | — | |
| SCHEMBL491545 | 0.83 | SIGMAR1 (0.67) | ALDH1A1KDM4ESMN1; SMN2HTR7HTR1A | |
| SCHEMBL15630732 | 0.83 | ALDH1A1 (0.71) | ALDH1A1KDM4ESMN1; SMN2HPGDL3MBTL1 | |
| SCHEMBL7917296 | 0.82 | KDM4E (0.62) | ALDH1A1KDM4EHTR7HTR1ADRD2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0066456-B1 | N-SUBSTITUTED AZAHETEROCYCLIC CARBOXYLIC ACIDS AND THEIR ESTERS | SMITHKLINE BECKMAN CORPORATION (US) | 1985-04-24 | — | — | EP | disclosed |
| US-4383999-A | GAMMA-AMINOBUTYRIC ACID SEDATIVES, ANALGESTICS, ANTIEPILEPTIC, MUSCULAR AND PSYCHOLOGICAL DISORDERS | SMITHKLINE BECKMAN CORPORATION (US) | 1983-05-17 | — | — | US | disclosed |
| EP-0066456-A1 | N-substituted azaheterocyclic carboxylic acids and their esters | SMITHKLINE BECKMAN CORPORATION (US) | 1982-12-08 | — | — | EP | disclosed |