Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | PARP1 | P09874 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | APEX1 | P27695 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | CASP6 | P55212 | 1/20 | 0.31 |
| ▸ | NFKB2 | Q00653 | 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 | |
|---|---|---|---|---|
| SCHEMBL525750 | 0.72 | HCAR2 (0.40) | ALDH1A1SMN1; SMN2TSHRKDM4EHSD17B10 | |
| SCHEMBL525484 | 0.71 | BRD4 (0.47) | ALDH1A1SMN1; SMN2KDM4EHSD17B10HPGD | |
| SCHEMBL13185711 | 0.70 | — | — | |
| SCHEMBL9024849 | 0.68 | SMN1; SMN2 (0.42) | ALDH1A1SMN1; SMN2NR3C1PGRTSHR | |
| SCHEMBL12499447 | 0.68 | MAPT (0.48) | ALDH1A1SMN1; SMN2TSHRKDM4EHSD17B10 | |
| SCHEMBL12094403 | 0.66 | SMN1; SMN2 (0.41) | ALDH1A1SMN1; SMN2TSHRKDM4EHSD17B10 | |
| SCHEMBL3131565 | 0.64 | SMN1; SMN2 (0.42) | ALDH1A1SMN1; SMN2NR3C1TSHRKDM4E | |
| SCHEMBL19153169 | 0.60 | TSHR (0.43) | ALDH1A1PARP1TSHRKDM4EHSD17B10 | |
| SCHEMBL19152921 | 0.60 | ALDH1A1 (0.39) | ALDH1A1SMN1; SMN2TSHRKDM4EHSD17B10 | |
| SCHEMBL10286509 | 0.60 | KDM4E (0.35) | ALDH1A1SMN1; SMN2PARP1TSHRKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-5604224-A | NEURODEGENERATIVE DISORDERS | STERLING WINTHROP INC. (US) | 1997-02-18 | — | — | US | disclosed |
| US-5569655-A | Substituted heterocyclylisoquinolinium salts and compositions and method of use thereof | STERLING WINTHROP INC. (US) | 1996-10-29 | — | — | US | disclosed |
| EP-0647641-A1 | Substituted heterocyclylisoquinolinium salts and compositions and methods of usethereof | STERLING WINTHROP INC. (US) | 1995-04-12 | — | — | EP | disclosed |