Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 4/20 | 0.48 |
| ▸ | ME2 | P23368 | 3/20 | 0.48 |
| ▸ | ME1 | P48163 | 3/20 | 0.48 |
| ▸ | ME3 | Q16798 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | CKS1B | P61024 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL12412525 | 0.86 | SMN1; SMN2 (0.54) | SMN1; SMN2HPGDAOC3ALDH1A1L3MBTL1 | |
| SCHEMBL18711414 | 0.82 | SMN1; SMN2 (0.70) | SMN1; SMN2HPGDALDH1A1L3MBTL1KDM4E | |
| SCHEMBL12377892 | 0.78 | AOC3 (0.62) | SMN1; SMN2HPGDAOC3ALDH1A1L3MBTL1 | |
| SCHEMBL29576128 | 0.76 | ME2 (0.60) | HPGDAOC3ALDH1A1L3MBTL1GAA | |
| SCHEMBL1630859 | 0.76 | L3MBTL1 (0.58) | SMN1; SMN2HPGDAOC3ALDH1A1L3MBTL1 | |
| SCHEMBL11930058 | 0.75 | SMN1; SMN2 (0.80) | SMN1; SMN2HPGDALDH1A1GAAHSD17B10 | |
| SCHEMBL18711280 | 0.75 | PANK3 (0.60) | HPGDAOC3ALDH1A1L3MBTL1GAA | |
| SCHEMBL1630856 | 0.75 | ALDH1A1 (0.56) | SMN1; SMN2HPGDAOC3ALDH1A1L3MBTL1 | |
| SCHEMBL20804512 | 0.75 | ALDH1A1 (0.56) | SMN1; SMN2HPGDAOC3ALDH1A1L3MBTL1 | |
| SCHEMBL30434376 | 0.75 | AKR1C3 (0.66) | HPGDAOC3ALDH1A1L3MBTL1GAA |
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 |
|---|---|---|---|---|---|---|---|
| US-9624229-B2 | Pyrimidine-2-amine compounds and their use as inhibitors of JAK kinases | RIGEL PHARMACEUTICALS, INC. (US) | 2017-04-18 | — | — | US | disclosed |