Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCD | O00767 | 10/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 6/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | FAAH | O00519 | 1/20 | 0.40 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.40 |
| ▸ | CDK9 | P50750 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5399467 | 0.84 | GRIN2B (0.58) | SCDGRIN2BEPHX2CYP3A4CYP2D6 | |
| SCHEMBL6582799 | 0.83 | CCNT1 (0.38) | SCDGRIN2BCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL5412796 | 0.81 | SCD (0.45) | SCDGRIN2BEPHX2CYP3A4CYP2D6 | |
| SCHEMBL6586188 | 0.80 | GRIN2B (0.41) | SCDGRIN2BCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL5409925 | 0.80 | GRIN2B (0.55) | SCDGRIN2BEPHX2CYP3A4CYP2D6 | |
| SCHEMBL6580888 | 0.80 | SCD (0.43) | SCDGRIN2BEPHX2 | |
| SCHEMBL6586267 | 0.80 | SCD (0.51) | SCDGRIN2BEPHX2FAAH | |
| SCHEMBL6580878 | 0.77 | SCD (0.44) | SCD | |
| SCHEMBL6586187 | 0.74 | SCD (0.45) | SCD | |
| SCHEMBL5394852 | 0.73 | SCD (0.43) | SCDGRIN2BEPHX2 |
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-1455788-A1 | 1-GLYCINYL-4-AMINOMETHYL-PIPERIDINE DERIVATIVES AS FACTOR XA INHIBITORS | ELI LILLY AND COMPANY (US) | 2004-09-15 | — | — | EP | disclosed |
| WO-2003049737-A1 | CHEMICAL COMPOUNDS | ELI LILLY AND COMPANY (US) | 2003-06-19 | — | — | WO | disclosed |