Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.61 |
| ▸ | MAPT | P10636 | 2/20 | 0.58 |
| ▸ | TSHR | P16473 | 2/20 | 0.58 |
| ▸ | GFER | P55789 | 1/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.53 |
| ▸ | DRD2 | P14416 | 2/20 | 0.53 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | CASP1 | P29466 | 1/20 | 0.47 |
| ▸ | CASP4 | P49662 | 1/20 | 0.47 |
| ▸ | CASP5 | P51878 | 1/20 | 0.47 |
| ▸ | DRD4 | P21917 | 2/20 | 0.45 |
| ▸ | DRD3 | P35462 | 1/20 | 0.45 |
| ▸ | HTR1A | P08908 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7767380 | 0.90 | DRD4 (0.53) | KDM4EALDH1A1SMN1; SMN2MAPTTSHR | |
| SCHEMBL7766463 | 0.81 | HTR7 (0.61) | KDM4EALDH1A1TSHRDRD2DRD4 | |
| SCHEMBL7762764 | 0.81 | KDM4E (0.55) | KDM4EALDH1A1SMN1; SMN2MAPTDRD2 | |
| SCHEMBL8570664 | 0.77 | SIGMAR1 (0.81) | KDM4EALDH1A1SMN1; SMN2MAPTTSHR | |
| SCHEMBL7765506 | 0.77 | CA2 (0.46) | KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL7762716 | 0.76 | KDM4E (0.56) | KDM4EALDH1A1SMN1; SMN2TSHRDRD2 | |
| SCHEMBL25370948 | 0.76 | KDM4E (0.80) | KDM4EALDH1A1SMN1; SMN2MAPTTSHR | |
| SCHEMBL6031705 | 0.76 | KDM4E (1.00) | KDM4EALDH1A1SMN1; SMN2MAPTTSHR | |
| SCHEMBL27395515 | 0.76 | KDM4E (0.80) | KDM4EALDH1A1SMN1; SMN2MAPTTSHR | |
| Hydrochloric Acid SCHEMBL8406359 | 0.76 | KDM4E (0.55) | KDM4EALDH1A1SMN1; SMN2TSHRDRD2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0841330-A1 | Aminomethyl heterocyclic derivatives, process of their preparation and pharmaceutical compositions containing them | ADIR ET COMPAGNIE (FR) | 1998-05-13 | — | — | EP | disclosed |