Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL11631073 | 0.80 | LMNA (0.34) | — | |
| SCHEMBL11630992 | 0.79 | HTR2C (0.37) | — | |
| SCHEMBL11301329 | 0.77 | — | — | |
| SCHEMBL22204379 | 0.76 | — | — | |
| SCHEMBL19936066 | 0.71 | SIGMAR1 (0.40) | HTT | |
| SCHEMBL28057484 | 0.70 | — | — | |
| SCHEMBL891398 | 0.70 | SIGMAR1 (0.50) | HTTEPHX1 | |
| SCHEMBL24180077 | 0.70 | SIGMAR1 (0.34) | — | |
| SCHEMBL12019279 | 0.68 | CHRNB4 (0.36) | HTTCA1CA2 | |
| SCHEMBL11084808 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4113464-A | HERBICIDES | VELSICOL CHEMICAL COMPANY (US) | 1978-09-12 | — | — | US | disclosed |