Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC1A1 | P43005 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 3/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | MGAM | O43451 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | SI | P14410 | 1/20 | 0.30 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1410114 | 0.81 | HDAC3 (0.37) | — | |
| SCHEMBL1410112 | 0.81 | HDAC3 (0.37) | — | |
| SCHEMBL645887 | 0.77 | ALDH1A1 (0.33) | SLC1A1ALDH1A1 | |
| SCHEMBL6592821 | 0.72 | — | — | |
| SCHEMBL2018995 | 0.70 | SLC1A1 (0.58) | SLC1A1 | |
| SCHEMBL16838812 | 0.70 | TSHR (0.42) | SLC1A1TSHRALDH1A1HSD17B10MGAM | |
| SCHEMBL5674932 | 0.70 | MGAM (0.44) | SLC1A1TSHRALDH1A1HSD17B10MGAM | |
| SCHEMBL29115441 | 0.70 | TSHR (0.42) | SLC1A1TSHRALDH1A1HSD17B10MGAM | |
| SCHEMBL10005848 | 0.70 | MGAM (0.44) | SLC1A1TSHRALDH1A1HSD17B10MGAM | |
| SCHEMBL151676 | 0.70 | SLC1A1 (0.58) | SLC1A1 |
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-1993014777-A1 | PEPTIDYL DERIVATIVES AS INHIBITORS OF INTERLEUKIN-1β CONVERTING ENZYME | MERCK & CO., INC. (US) | 1993-08-05 | — | — | WO | disclosed |