Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 15/20 | 0.65 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.61 |
| ▸ | PTGES | O14684 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 2/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CASP3 | P42574 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.37 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.37 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9458593 | 1.00 | ALOX5 (0.65) | ALOX5PTGS1PTGESESR1ESR2 | |
| SCHEMBL9458748 | 0.86 | ALOX5 (0.46) | ALOX5PTGS1PTGES | |
| SCHEMBL9458579 | 0.79 | ALOX5 (1.00) | ALOX5PTGS1PTGES | |
| SCHEMBL9459144 | 0.78 | PTGES (0.53) | ALOX5PTGS1PTGES | |
| SCHEMBL9458649 | 0.75 | PTGES (0.44) | ALOX5PTGS1PTGES | |
| SCHEMBL9458503 | 0.74 | ALOX5 (0.70) | ALOX5PTGS1PTGESNPC1ALDH1A1 | |
| SCHEMBL9458836 | 0.72 | ALOX5 (0.70) | ALOX5PTGS1PTGES | |
| SCHEMBL9458881 | 0.70 | OXER1 (0.52) | ALOX5PTGS1PTGES | |
| SCHEMBL10445135 | 0.68 | ALOX5 (0.52) | ALOX5PTGS1PTGESALDH1A1 | |
| SCHEMBL9458661 | 0.68 | CYP2D6 (0.39) | PTGS1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5260451-A | Enzyme inhibitors | MERCKLE GMBH (DE) | 1993-11-09 | — | — | US | disclosed |
| EP-0397175-A1 | Substituted pyrrolizine compounds and theit use as pharmaceuticals | Dannhardt, Gerd, Prof.Dr. (DE) | 1990-11-14 | — | — | EP | disclosed |