Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPY2R | P49146 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | GRM5 | P41594 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11559895 | 0.89 | CYP1A2 (0.54) | ALDH1A1POLBSMN1; SMN2GRM5CYP2C19 | |
| SCHEMBL11552932 | 0.87 | GRM5 (0.54) | ALDH1A1POLBSMN1; SMN2USP2CYP2D6 | |
| SCHEMBL11559621 | 0.86 | ALDH1A1 (0.44) | ALDH1A1POLBSMN1; SMN2GRM5MEN1 | |
| SCHEMBL15833905 | 0.83 | HPGD (0.57) | ALDH1A1POLBSMN1; SMN2USP2CYP2D6 | |
| SCHEMBL11580323 | 0.81 | CYP2C19 (0.38) | ALDH1A1SMN1; SMN2USP2CYP2D6MAPK1 | |
| SCHEMBL11554285 | 0.75 | MAPT (0.42) | ALDH1A1POLBSMN1; SMN2HPGDMEN1 | |
| SCHEMBL3997777 | 0.74 | GRM5 (0.49) | SMN1; SMN2USP2GRM5 | |
| SCHEMBL27723918 | 0.72 | ALDH1A1 (0.82) | NPY2RALDH1A1POLBSMN1; SMN2HPGD | |
| SCHEMBL11560724 | 0.72 | QDPR (0.46) | KMT2ALMNA | |
| SCHEMBL11578372 | 0.71 | SMN1; SMN2 (0.37) | ALDH1A1POLBSMN1; SMN2GRM5LMNA |
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-0000167-A1 | 1,2,3,6-Tetrahydroisonicotinic acid and derivatives thereof, methods and starting products for their preparation, and pharmaceutical compositions containing them. | Krogsgaard-Larsen, Povl (DK) | 1979-01-10 | — | — | EP | disclosed |