Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL19102079 | 0.82 | CYP2C19 (0.36) | CYP2C19MEN1GLAKMT2ACYP1A2 | |
| SCHEMBL17346334 | 0.79 | — | — | |
| SCHEMBL28211595 | 0.78 | CYP2C19 (0.33) | CYP2C19MEN1GLAKMT2ACYP1A2 | |
| SCHEMBL13919266 | 0.78 | — | — | |
| SCHEMBL20959866 | 0.77 | CYP2C19 (0.32) | CYP2C19MEN1GLAKMT2ACYP1A2 | |
| SCHEMBL2184102 | 0.76 | FDPS (0.37) | — | |
| SCHEMBL22958634 | 0.76 | TSHR (0.39) | CYP2C19MEN1GLAKMT2ACYP1A2 | |
| SCHEMBL13452838 | 0.72 | — | — | |
| SCHEMBL193496 | 0.72 | — | — | |
| SCHEMBL234189 | 0.72 | — | — |
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-20170082645-A1 | NEAR-INFRARED FLUORESCENT SENSORS FOR BIOLOGICAL AMINES | THE CURATORS OF THE UNIVERSITY OF MISSOURI | 2017-03-23 | — | — | US | disclosed |