Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LDHA | P00338 | 7/20 | 0.58 |
| ▸ | DAO | P14920 | 1/20 | 0.47 |
| ▸ | CCR2 | P41597 | 2/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7982 | 0.76 | LDHA (0.58) | LDHADAOALDH1A1 | |
| SCHEMBL14118756 | 0.74 | LDHA (0.56) | LDHADAOALDH1A1 | |
| SCHEMBL7814 | 0.74 | LDHA (1.00) | LDHADAOCCR2MCL1ALDH1A1 | |
| SCHEMBL7300 | 0.74 | LDHA (1.00) | LDHADAOCCR2MCL1ALDH1A1 | |
| SCHEMBL13306 | 0.73 | LDHA (0.79) | LDHADAOCCR2 | |
| SCHEMBL7108 | 0.72 | LDHA (0.82) | LDHADAOCCR2MCL1ALDH1A1 | |
| SCHEMBL7835 | 0.72 | LDHA (0.77) | LDHADAOCCR2MCL1 | |
| SCHEMBL7582 | 0.72 | LDHA (0.77) | LDHADAOCCR2MCL1ALDH1A1 | |
| SCHEMBL8712 | 0.70 | LDHA (0.78) | LDHADAOCCR2ALDH1A1 | |
| SCHEMBL2761565 | 0.69 | MCL1 (0.51) | MCL1ALDH1A1 |
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-2499114-A1 | COMPOUNDS INHIBITORS OF ENZYME LACTATE DEHYDROGENASE (LDH) AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS | Universita Di Pisa (IT) | 2012-09-19 | — | — | EP | disclosed |
| WO-2011054525-A1 | COMPOUNDS INHIBITORS OF ENZYME LACTATE DEHYDROGENASE (LDH) AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS | UNIVERSITA' DI PISA (IT) | 2011-05-12 | — | — | WO | disclosed |