Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.69 |
| ▸ | TSHR | P16473 | 2/20 | 0.69 |
| ▸ | LMNA | P02545 | 1/20 | 0.69 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.55 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.55 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.55 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.55 |
| ▸ | RELA | Q04206 | 1/20 | 0.55 |
| ▸ | GLS | O94925 | 2/20 | 0.53 |
| ▸ | ELOVL1 | Q9BW60 | 1/20 | 0.53 |
| ▸ | SCD | O00767 | 1/20 | 0.53 |
| ▸ | CCNE1 | P24864 | 6/20 | 0.52 |
| ▸ | CDK2 | P24941 | 6/20 | 0.52 |
| ▸ | CDK5 | Q00535 | 6/20 | 0.52 |
| ▸ | HTT | P42858 | 2/20 | 0.52 |
| ▸ | RAB9A | P51151 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | BLM | P54132 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL17988257 | 0.86 | FFAR2 (0.56) | ALDH1A1TSHRLMNAROCK2SMN1; SMN2 | |
| SCHEMBL6977028 | 0.83 | PRKACA (0.51) | ALDH1A1TSHRLMNAROCK2SMN1; SMN2 | |
| SCHEMBL10082486 | 0.83 | ALDH1A1 (0.66) | ALDH1A1TSHRLMNASMN1; SMN2NFKB1 | |
| SCHEMBL10068184 | 0.82 | ALDH1A1 (0.64) | ALDH1A1TSHRLMNASMN1; SMN2NFKB1 | |
| SCHEMBL7856485 | 0.80 | ROCK2 (0.49) | ALDH1A1TSHRLMNAROCK2SMN1; SMN2 | |
| SCHEMBL1377141 | 0.77 | ADORA3 (0.68) | LMNASMN1; SMN2RAB9AMEN1MAPT | |
| SCHEMBL28268613 | 0.77 | RAB9A (0.75) | ALDH1A1TSHRLMNASMN1; SMN2ELOVL1 | |
| SCHEMBL1855039 | 0.76 | RAB9A (0.58) | ALDH1A1TSHRLMNAROCK2SMN1; SMN2 | |
| SCHEMBL822338 | 0.75 | TSHR (0.59) | ALDH1A1TSHRLMNASMN1; SMN2NFKB1 | |
| SCHEMBL3759738 | 0.75 | GRM1 (0.49) | ALDH1A1TSHRLMNAROCK2SMN1; SMN2 |
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-0455356-A1 | Substituted 5-amino-1,2,4-thiadiazoles with pharmaceutical activity | LILLY INDUSTRIES LIMITED (GB) | 1991-11-06 | — | — | EP | disclosed |