Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | CA12 | O43570 | 3/20 | 0.41 |
| ▸ | CA2 | P00918 | 3/20 | 0.41 |
| ▸ | CA9 | Q16790 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3792911 | 0.93 | APP (0.63) | APPMAPTCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL5141153 | 0.91 | APP (0.55) | APPMAPTCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL3791702 | 0.88 | APP (0.57) | APPMAPTCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL1195805 | 0.88 | APP (0.71) | APPMAPTCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL3797526 | 0.81 | APP (0.60) | APPMAPTCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL3786925 | 0.79 | APP (0.57) | APPMAPTCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL3786899 | 0.79 | APP (0.57) | APPMAPTCYP1A2CYP3A4CYP2C9 | |
| Benzoic Acid SCHEMBL6074880 | 0.78 | DAO (0.52) | APPMAPTCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL7787325 | 0.77 | APP (0.55) | APPMAPTCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL3796509 | 0.77 | APP (0.80) | APPMAPTCYP1A2CYP3A4CYP2C9 |
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-20080006121-A1 | Fe3Pd phase and Mn in fcc form; for a rigid carbon composition; from melting an ethynyl organic compound and a metallic compound; in bulk; | NAVY, UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE, THE | 2008-01-10 | — | — | US | disclosed |