Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL25166279 | 0.80 | P2RX7 (0.38) | CYP3A4P2RX7 | |
| SCHEMBL24785949 | 0.73 | — | — | |
| SCHEMBL19651204 | 0.67 | P2RX7 (0.40) | CYP3A4TSHRP2RX7 | |
| SCHEMBL13689798 | 0.67 | CYP3A4 (0.48) | CYP3A4TSHRP2RX7CA1CA2 | |
| SCHEMBL17263342 | 0.64 | CYP3A4 (0.50) | CYP3A4TSHRP2RX7CA1CA2 | |
| SCHEMBL20076361 | 0.64 | CYP3A4 (0.50) | CYP3A4TSHRP2RX7CA1CA2 | |
| SCHEMBL21021855 | 0.64 | CYP3A4 (0.32) | CYP3A4TSHRP2RX7 | |
| SCHEMBL19101609 | 0.64 | TSHR (0.32) | CYP3A4TSHR | |
| SCHEMBL1099858 | 0.63 | CYP3A4 (0.48) | CYP3A4TSHRP2RX7CA1CA2 | |
| SCHEMBL2553178 | 0.63 | CYP3A4 (0.48) | CYP3A4TSHRP2RX7CA1CA2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009126863-A2 | PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING | GENENTECH, INC. (US) | 2009-10-15 | — | — | WO | disclosed |