Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 5/20 | 0.43 |
| ▸ | KIF11 | P52732 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 2/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | HTR7 | P34969 | 1/20 | 0.40 |
| ▸ | NOS3 | P29474 | 2/20 | 0.39 |
| ▸ | NOS1 | P29475 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 2/20 | 0.37 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6243015 | 0.98 | SLC6A4 (0.42) | SLC6A4KIF11MAOASLC6A2SLC6A3 | |
| SCHEMBL3667550 | 0.87 | ALDH1A1 (0.48) | SLC6A4KIF11MAOASLC6A3ALDH1A1 | |
| SCHEMBL1569974 | 0.81 | NPC1 (0.52) | KIF11ALDH1A1MAPK1 | |
| SCHEMBL23916317 | 0.78 | MAPK1 (0.48) | KIF11ALDH1A1MAPK1CA12CA1 | |
| SCHEMBL2154868 | 0.77 | TAAR1 (0.52) | SLC6A4KIF11MAOAALDH1A1CA12 | |
| SCHEMBL5382245 | 0.76 | CA2 (0.50) | KIF11SLC6A2ALDH1A1MAPK1CA12 | |
| SCHEMBL6192990 | 0.76 | MAPT (0.45) | KIF11MAOAALDH1A1MAOB | |
| SCHEMBL4373571 | 0.76 | SMN1; SMN2 (0.50) | KIF11MAOAALDH1A1MAPK1MAOB | |
| SCHEMBL2154362 | 0.76 | SLC6A4 (0.50) | SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL2153559 | 0.76 | ALDH1A1 (0.53) | KIF11MAOAALDH1A1MAPK1CA12 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004016583-A1 | SUBSTITUTED GLYCINE DERIVATIVES FOR USE AS MEDICAMENTS | PFIZER LIMITED (GB) | 2004-02-26 | — | — | WO | disclosed |