Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LOXL2 | Q9Y4K0 | 4/20 | 0.45 |
| ▸ | F10 | P00742 | 1/20 | 0.45 |
| ▸ | NOS3 | P29474 | 2/20 | 0.42 |
| ▸ | NOS1 | P29475 | 2/20 | 0.42 |
| ▸ | NOS2 | P35228 | 2/20 | 0.42 |
| ▸ | ABAT | P80404 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | F11 | P03951 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27528866 | 1.00 | LOXL2 (0.45) | LOXL2F10NOS3NOS1NOS2 | |
| SCHEMBL27913568 | 0.81 | LOXL2 (0.50) | LOXL2F10NOS3NOS1NOS2 | |
| SCHEMBL27820239 | 0.78 | LOXL2 (0.40) | LOXL2F10NOS3NOS1NOS2 | |
| SCHEMBL28789528 | 0.78 | LOXL2 (0.43) | LOXL2F10NOS3NOS1NOS2 | |
| SCHEMBL18905389 | 0.77 | THRB (0.36) | — | |
| SCHEMBL10579685 | 0.77 | ESR1 (0.54) | SMN1; SMN2 | |
| SCHEMBL10446347 | 0.77 | ALDH1A1 (0.41) | SMN1; SMN2 | |
| SCHEMBL10446344 | 0.77 | ALDH1A1 (0.41) | SMN1; SMN2 | |
| SCHEMBL11485606 | 0.77 | ESR1 (0.54) | SMN1; SMN2 | |
| SCHEMBL19073754 | 0.77 | ALDH1A1 (0.41) | SMN1; SMN2 |
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-2008099074-A1 | PHENYL- (4-PHENYL-PYRIMIDIN-2-YL) - AMINE DERIVATIVES AS IKK INHIBITORS, PREPARATION THEREOF, AND PHARMACEUTICAL COMPOSITIONS THEREOF | SANOFI-AVENTIS (FR) | 2008-08-21 | — | — | WO | disclosed |