Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 3/20 | 0.57 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.57 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.45 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.45 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.45 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.45 |
| ▸ | CCR2 | P41597 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | FLT1 | P17948 | 1/20 | 0.41 |
| ▸ | FLT4 | P35916 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8091401 | 0.89 | PTGS1 (0.60) | PTGS1PTGS2CCR2ALDH1A1TP53 | |
| SCHEMBL8481953 | 0.86 | PTGS1 (0.59) | PTGS1PTGS2CCR2ALDH1A1TP53 | |
| SCHEMBL8480176 | 0.85 | PTGS1 (0.60) | PTGS1PTGS2CCR2ALDH1A1TP53 | |
| SCHEMBL8092102 | 0.85 | PTGS1 (0.60) | PTGS1PTGS2CCR2ALDH1A1TP53 | |
| SCHEMBL8479562 | 0.85 | PTGS1 (0.53) | PTGS1PTGS2CCR2ALDH1A1TP53 | |
| SCHEMBL8107816 | 0.84 | PTGS1 (0.52) | PTGS1PTGS2CCR2TP53LMNA | |
| SCHEMBL8101589 | 0.84 | PTGS2 (0.61) | PTGS1PTGS2CCR2ALDH1A1TP53 | |
| SCHEMBL8100691 | 0.83 | PTGS1 (0.58) | PTGS1PTGS2CCR2ALDH1A1TP53 | |
| Hydrochloric Acid SCHEMBL8481799 | 0.83 | PTGS2 (0.60) | PTGS1PTGS2CCR2ALDH1A1TP53 | |
| SCHEMBL8091464 | 0.83 | PTGS2 (0.62) | PTGS1PTGS2CCR2ALDH1A1TP53 |
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-0848703-B1 | DERIVATIVES OF BENZOSULPHONAMIDES AS INHIBITORS OF THE ENZYME CYCLO-OXYGENASE II | NYCOMED AUSTRIA GMBH (AT) | 2000-09-27 | — | — | EP | disclosed |
| US-6004948-A | NON-STEROIDAL ANTIINFLAMMATORY AGENTS; SIDE EFFECT REDUCTION | NYCOMED AUSTRIA GMBH (AT) | 1999-12-21 | — | — | US | disclosed |