Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SGMS2 | Q8NHU3 | 4/20 | 0.64 |
| ▸ | NPC1 | O15118 | 1/20 | 0.60 |
| ▸ | HTT | P42858 | 1/20 | 0.60 |
| ▸ | GAA | P10253 | 1/20 | 0.59 |
| ▸ | PARP1 | P09874 | 1/20 | 0.57 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.54 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.54 |
| ▸ | ALPG | P10696 | 1/20 | 0.53 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.53 |
| ▸ | BRD4 | O60885 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| Bicarbonate SCHEMBL21753662 | 0.89 | SGMS2 (0.64) | SGMS2NPC1HTTGAAPARP1 | |
| Bicarbonate SCHEMBL236872 | 0.89 | SGMS2 (0.64) | SGMS2NPC1HTTGAAPARP1 | |
| Bicarbonate SCHEMBL29914194 | 0.89 | SGMS2 (0.64) | SGMS2NPC1HTTGAAPARP1 | |
| SCHEMBL29433417 | 0.87 | SGMS2 (0.66) | SGMS2NPC1HTTGAAPARP1 | |
| SCHEMBL112903 | 0.87 | SGMS2 (0.66) | SGMS2NPC1HTTGAAPARP1 | |
| SCHEMBL9696207 | 0.87 | SGMS2 (0.66) | SGMS2NPC1HTTGAAPARP1 | |
| Hydrochloric Acid SCHEMBL8998291 | 0.85 | SGMS2 (0.64) | SGMS2NPC1HTTGAAPARP1 | |
| SCHEMBL17799483 | 0.85 | SGMS2 (0.64) | SGMS2NPC1HTTGAAPARP1 | |
| SCHEMBL341109 | 0.84 | SGMS2 (0.62) | SGMS2NPC1HTTGAAPARP1 | |
| SCHEMBL718082 | 0.84 | PARP1 (0.79) | SGMS2NPC1HTTGAAPARP1 |
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-0758312-A4 | SUBSTITUTED FUSED AND BRIDGED BICYCLIC COMPOUNDS AS THERAPEUTIC AGENTS | LILLY CO ELI (US) | 1997-09-10 | — | — | EP | disclosed |
| US-5659027-A | BORONATED AT RING NITROGEN OF PURINE OR PYRIMIDINE BASE OR AT AN AMINO SUBSTITUENT OF THE NUCLEOSIDE SUGAR | UNIVERSITY OF NORTH CAROLINA (US) | 1997-08-19 | — | — | US | disclosed |
| EP-0758312-A1 | SUBSTITUTED FUSED AND BRIDGED BICYCLIC COMPOUNDS AS THERAPEUTIC AGENTS | ELI LILLY AND COMPANY (US) | 1997-02-19 | — | — | EP | disclosed |