Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL599835 | 0.88 | TSHR (0.45) | CYP2C19TSHRTP53TDP1 | |
| SCHEMBL30686724 | 0.83 | — | — | |
| Phosphoric Acid SCHEMBL17477136 | 0.81 | TSHR (0.39) | CYP2C19TSHRTP53TDP1 | |
| SCHEMBL10795188 | 0.79 | CYP2C19 (0.33) | CYP2C19TSHR | |
| SCHEMBL11419805 | 0.79 | TP53 (0.35) | CYP2C19TSHRTP53TDP1 | |
| SCHEMBL17999714 | 0.79 | CYP2C19 (0.33) | CYP2C19TSHR | |
| SCHEMBL5908907 | 0.79 | TSHR (0.65) | CYP2C19TSHRTP53TDP1 | |
| SCHEMBL22340062 | 0.76 | CYP2C19 (0.35) | CYP2C19TP53TDP1 | |
| SCHEMBL5908835 | 0.75 | CTSA (0.37) | CYP2C19 | |
| SCHEMBL5908967 | 0.75 | CYP3A4 (0.50) | CYP2C19TSHRTP53TDP1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7709409-B2 | Mixed catalytic composition | CHEMTURA ORGANOMETALLICS GMBH (DE) | 2010-05-04 | — | — | US | disclosed |
| US-20070179045-A1 | Mixed catalytic composition | PMC VLISSINGEN NETHERLANDS, B.V. (NL) | 2007-08-02 | — | — | US | disclosed |
| US-20060052575-A1 | Mixed catalyst composition | CHEMTURA ORGANOMETALLICS GMBH (DE) | 2006-03-09 | — | — | US | disclosed |
| EP-1567473-A1 | MIXED CATALYTIC COMPOSITION | Crompton GmbH (DE) | 2005-08-31 | — | — | EP | disclosed |
| WO-2004050597-A1 | MIXED CATALYTIC COMPOSITION | CROMPTON GMBH (DE) | 2004-06-17 | — | — | WO | disclosed |