Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.30 |
| ▸ | CHRNA5 | P30532 | 1/20 | 0.30 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.30 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.30 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3749163 | 1.00 | CYP3A4 (0.31) | CYP3A4CYP2D6CHRNB2CHRNA5CHRNA7 | |
| SCHEMBL4705448 | 0.94 | L3MBTL1 (0.31) | CYP3A4CYP2D6 | |
| SCHEMBL2347202 | 0.88 | — | — | |
| SCHEMBL4181741 | 0.88 | — | — | |
| SCHEMBL4187048 | 0.88 | — | — | |
| SCHEMBL3402133 | 0.78 | POLB (0.34) | — | |
| SCHEMBL3400563 | 0.78 | POLB (0.34) | — | |
| SCHEMBL14136838 | 0.78 | POLB (0.34) | — | |
| SCHEMBL15049918 | 0.78 | OPRM1 (0.36) | — | |
| SCHEMBL11972105 | 0.78 | OPRM1 (0.36) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2300457-B1 | SUBSTITUTED PYRROLES AND METHODS OF USE | GENENTECH INC (US) | 2014-08-20 | — | — | EP | disclosed |
| US-8410279-B2 | Substituted pyrroles and methods of use | GENENTECH, INC. (US) | 2013-04-02 | — | — | US | disclosed |
| EP-2300457-A1 | SUBSTITUTED PYRROLES AND METHODS OF USE | Genentech, Inc. (US) | 2011-03-30 | — | — | EP | disclosed |
| WO-2009151599-A1 | SUBSTITUTED PYRROLES AND METHODS OF USE | GENENTECH, INC. (US) | 2009-12-17 | — | — | WO | disclosed |