Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 10/20 | 0.65 |
| ▸ | LOX | P28300 | 1/20 | 0.56 |
| ▸ | LOXL3 | P58215 | 1/20 | 0.56 |
| ▸ | LOXL4 | Q96JB6 | 1/20 | 0.56 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.54 |
| ▸ | GFER | P55789 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 3/20 | 0.51 |
| ▸ | RAB9A | P51151 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.51 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL6700291 | 0.96 | CES2 (0.63) | CES2LOXLOXL3LOXL4LOXL2 | |
| Mofebutazone SCHEMBL27513530 | 0.84 | ALDH1A1 (0.57) | CES2LOXLOXL3LOXL4LOXL2 | |
| SCHEMBL6042079 | 0.84 | CES2 (0.67) | CES2LOXLOXL3LOXL4LOXL2 | |
| SCHEMBL4663174 | 0.84 | CES2 (0.67) | CES2LOXLOXL3LOXL4LOXL2 | |
| SCHEMBL419526 | 0.81 | CES2 (0.68) | CES2LOXLOXL3LOXL4LOXL2 | |
| SCHEMBL3438740 | 0.81 | CES2 (0.63) | CES2LOXLOXL3LOXL4LOXL2 | |
| Bromide SCHEMBL27001736 | 0.80 | CES2 (0.55) | CES2LOXLOXL3LOXL4LOXL2 | |
| Bromide SCHEMBL27001757 | 0.79 | CES2 (0.54) | CES2LOXLOXL3LOXL4LOXL2 | |
| SCHEMBL4663223 | 0.79 | CES2 (0.68) | CES2LOXLOXL3LOXL4LOXL2 | |
| SCHEMBL13104005 | 0.79 | CES2 (1.00) | CES2LOXLOXL3LOXL4LOXL2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1861375-A1 | DIPYRAZOLES AS CENTRAL NERVOUS SYSTEM AGENTS | Aventis Pharmaceuticals Inc. (US) | 2007-12-05 | — | — | EP | disclosed |
| WO-2006101903-A1 | DIPYRAZOLES AS CENTRAL NERVOUS SYSTEM AGENTS | AVENTIS PHARMACEUTICALS INC. (US) | 2006-09-28 | — | — | WO | disclosed |
| WO-2004013252-A1 | ELECTROLUMINESCENT MATERIALS AND DEVICES | ELAM-T LIMITED (GB) | 2004-02-12 | — | — | WO | disclosed |