Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28765829 | 0.84 | SMN1; SMN2 (0.41) | SMN1; SMN2NPC1RAB9ATSHRPOLB | |
| SCHEMBL8871055 | 0.79 | SMN1; SMN2 (0.47) | SMN1; SMN2NPC1RAB9ATSHRPOLB | |
| SCHEMBL152733 | 0.78 | NUDT1 (0.49) | SMN1; SMN2NPC1RAB9ATSHRKMT2A | |
| SCHEMBL2994680 | 0.78 | NPC1 (0.47) | SMN1; SMN2NPC1RAB9AKMT2AALDH1A1 | |
| Bromide SCHEMBL29572453 | 0.77 | NUDT1 (0.48) | SMN1; SMN2NPC1RAB9ATSHRKMT2A | |
| Hydrochloric Acid SCHEMBL6175391 | 0.77 | NUDT1 (0.48) | SMN1; SMN2NPC1RAB9ATSHRKMT2A | |
| Hydrochloric Acid SCHEMBL29571385 | 0.77 | NUDT1 (0.48) | SMN1; SMN2NPC1RAB9ATSHRKMT2A | |
| SCHEMBL5161099 | 0.76 | KDM4E (0.44) | NPC1RAB9ATSHRKMT2AALDH1A1 | |
| Phosphoric Acid SCHEMBL28214674 | 0.76 | NUDT1 (0.44) | SMN1; SMN2NPC1RAB9ATSHRKMT2A | |
| SCHEMBL1937210 | 0.76 | RAB9A (0.46) | SMN1; SMN2NPC1RAB9AKMT2AALDH1A1 |
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-0468714-A2 | Peptide-polysaccharide-protein conjugate vaccines | MERCK & CO. INC. (US) | 1992-01-29 | — | — | EP | disclosed |