Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGAM | O43451 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | SI | P14410 | 1/20 | 0.34 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.34 |
| ▸ | LDHA | P00338 | 1/20 | 0.32 |
| ▸ | SRR | Q9GZT4 | 1/20 | 0.32 |
| ▸ | FAAH | O00519 | 1/20 | 0.31 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.30 |
| ▸ | ADRA1A | P35348 | 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 | |
|---|---|---|---|---|
| SCHEMBL4334241 | 0.98 | MGAM (0.36) | MGAMGAASIMGAM2LDHA | |
| SCHEMBL4334244 | 0.87 | MGAM (0.46) | MGAMGAASIMGAM2FAAH | |
| SCHEMBL2885490 | 0.81 | GAA (0.46) | MGAMGAASIMGAM2FAAH | |
| SCHEMBL2587969 | 0.79 | ADRA2A (0.43) | EGLN1TSHRADRA2AADRA1A | |
| SCHEMBL9518327 | 0.78 | CA4 (0.35) | MGAMGAASIMGAM2FAAH | |
| SCHEMBL2724170 | 0.76 | DGKA (0.47) | TSHR | |
| SCHEMBL28736793 | 0.76 | TSHR (0.50) | TSHRADRA2AADRA1A | |
| SCHEMBL4849723 | 0.76 | MGAM (0.39) | MGAMGAASIMGAM2LDHA | |
| SCHEMBL12296672 | 0.76 | NAAA (0.50) | MGAMGAASIMGAM2ADRA2A | |
| SCHEMBL154678 | 0.75 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0300657-B1 | 4-SUBSTITUTED 3-OXOBUTANOATE ESTER DERIVATIVES | MERCK & CO. INC. (US) | 1993-03-31 | — | — | EP | disclosed |
| EP-0300657-A2 | 4-substituted 3-oxobutanoate ester derivatives | MERCK & CO. INC. (US) | 1989-01-25 | — | — | EP | disclosed |