Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.32 |
| ▸ | MGAM | O43451 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | SI | P14410 | 1/20 | 0.32 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20624808 | 0.79 | NPSR1 (0.37) | NPSR1GLO1ALDH1A1TSHRALOX15 | |
| SCHEMBL6531427 | 0.78 | NPSR1 (0.42) | NPSR1GLO1ALDH1A1TSHRALOX15 | |
| SCHEMBL8204396 | 0.76 | NPSR1 (0.33) | NPSR1GLO1ALDH1A1TSHRALOX15 | |
| SCHEMBL16410842 | 0.76 | NPSR1 (0.41) | NPSR1GLO1ALDH1A1TSHRALOX15 | |
| SCHEMBL8156973 | 0.75 | ALDH1A1 (0.38) | NPSR1GLO1ALDH1A1TSHR | |
| SCHEMBL10494399 | 0.74 | HCAR2 (0.55) | NPSR1GLO1ALDH1A1TSHRALOX15 | |
| SCHEMBL10494406 | 0.74 | HCAR2 (0.55) | NPSR1GLO1ALDH1A1TSHRALOX15 | |
| SCHEMBL8230038 | 0.74 | ALDH1A1 (0.37) | NPSR1GLO1ALDH1A1TSHR | |
| SCHEMBL10047861 | 0.70 | ALDH1A1 (0.39) | NPSR1GLO1ALDH1A1TSHRALOX15 | |
| SCHEMBL20231979 | 0.70 | — | — |
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-2008082490-A2 | NOVEL JNK INHIBITORS | SCHERING CORPORATION (US) | 2008-07-10 | — | — | WO | disclosed |