Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CBLB | Q13191 | 2/20 | 0.39 |
| ▸ | LOX | P28300 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.36 |
| ▸ | JAK1 | P23458 | 1/20 | 0.36 |
| ▸ | TYK2 | P29597 | 1/20 | 0.36 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3465950 | 0.83 | PIM1 (0.42) | ALDH1A1KDM4EALOX15TSHRACMSD | |
| SCHEMBL5547208 | 0.79 | LOX (0.51) | ALDH1A1ALOX15LOXLMNAPTGS2 | |
| SCHEMBL455687 | 0.79 | KDM4E (0.59) | ALDH1A1KDM4EALOX15TSHRACMSD | |
| SCHEMBL6641842 | 0.77 | KDM4E (0.56) | ALDH1A1KDM4EALOX15TSHRACMSD | |
| Hydrochloric Acid SCHEMBL27613793 | 0.77 | KDM4E (0.56) | ALDH1A1KDM4EALOX15TSHRACMSD | |
| Hydrochloric Acid SCHEMBL28930333 | 0.74 | ALDH1A1 (0.58) | ALDH1A1KDM4EALOX15TSHRACMSD | |
| SCHEMBL19127287 | 0.73 | KDM4E (0.56) | ALDH1A1KDM4ELMNAJAK1TYK2 | |
| SCHEMBL10556900 | 0.73 | ALDH1A1 (0.50) | ALDH1A1KDM4EALOX15TSHRACMSD | |
| SCHEMBL247491 | 0.71 | P2RX7 (0.60) | ALDH1A1KDM4EALOX15TSHRACMSD | |
| SCHEMBL31617698 | 0.71 | ALDH1A1 (0.48) | ALDH1A1KDM4EALOX15TSHRACMSD |
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-1572655-A2 | NOVEL ARYLHETEROALKYLAMINE DERIVATIVES | AstraZeneca AB (SE) | 2005-09-14 | — | — | EP | disclosed |
| WO-2002090332-A2 | NOVEL AEYLHETEROALKYLAMINΕ DERIVATIVES | ASTRAZENECA AB (SE) | 2002-11-14 | — | — | WO | disclosed |