Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 12/20 | 0.50 |
| ▸ | CTSD | P07339 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | SRC | P12931 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28991897 | 0.85 | SRC (0.45) | EPHX1CTSDCYP2D6LMNASRC | |
| SCHEMBL28095496 | 0.80 | TDP1 (0.50) | CYP2D6LMNA | |
| SCHEMBL28032290 | 0.79 | EPHX1 (0.39) | EPHX1CYP2D6SRC | |
| SCHEMBL28787282 | 0.78 | EPHX1 (0.53) | EPHX1CTSDCYP2D6LMNASRC | |
| SCHEMBL1569023 | 0.75 | NPC1 (0.51) | EPHX1CTSDCYP2D6LMNA | |
| SCHEMBL6796251 | 0.73 | EPHX1 (0.71) | EPHX1LMNA | |
| SCHEMBL1483540 | 0.72 | EPHX1 (0.46) | EPHX1CTSDCYP2D6LMNASRC | |
| SCHEMBL19716698 | 0.72 | EPHX1 (0.51) | EPHX1CTSDLMNA | |
| Hydrochloric Acid SCHEMBL8413696 | 0.71 | EPHX1 (0.44) | EPHX1CTSDCYP2D6LMNASRC | |
| SCHEMBL31130672 | 0.70 | SRC (0.39) | CYP2D6LMNASRC |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2250162-A2 | AMIDE DERIVATIVES AS POSITIVE ALLOSTERIC MODULATORS AND METHODS OF USE THEREOF | Abbott Laboratories (US) | 2010-11-17 | — | — | EP | disclosed |
| WO-2009100294-A2 | AMIDE DERIVATIVES AS POSITIVE ALLOSTERIC MODULATORS AND METHODS OF USE THEREOF | ABBOTT LABORATORIES (US) | 2009-08-13 | — | — | WO | disclosed |