Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL5177007 | 0.90 | ALOX5 (0.31) | ALOX5PTGS2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL5174975 | 0.88 | ALOX5 (0.32) | ALOX5PTGS2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL2805853 | 0.87 | NPC1 (0.30) | — | |
| SCHEMBL2802233 | 0.87 | CYP19A1 (0.32) | — | |
| Hydrochloric Acid SCHEMBL6039989 | 0.83 | — | — | |
| SCHEMBL5614277 | 0.78 | CYP19A1 (0.32) | — | |
| SCHEMBL7945474 | 0.77 | ALDH1A1 (0.31) | — | |
| SCHEMBL16411361 | 0.75 | — | — | |
| SCHEMBL6905177 | 0.75 | RXRA (0.31) | — | |
| Hydrochloric Acid SCHEMBL6039899 | 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-1396495-B1 | Metallocenes with a single halogenide attached to the metal | BASELL POLYOLEFINE GMBH (DE) | 2007-01-17 | — | — | EP | disclosed |
| EP-1396495-A1 | Metallocenes with a single halogenide attached to the metal | Basell Polyolefine GmbH (DE) | 2004-03-10 | — | — | EP | disclosed |