Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.39 |
| ▸ | EGFR | P00533 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.37 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.37 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | GAA | P10253 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | CASP7 | P55210 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 3/20 | 0.35 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3174185 | 0.82 | SMN1; SMN2 (0.40) | SMN1; SMN2EGFRKDM4EKMT2ACYP4F2 | |
| SCHEMBL19475215 | 0.75 | KMT2A (0.49) | SMN1; SMN2EGFRKDM4EKMT2ACYP4F2 | |
| SCHEMBL11078552 | 0.72 | KDM4E (0.40) | SMN1; SMN2EGFRKDM4EKMT2ACYP4F2 | |
| SCHEMBL28357703 | 0.71 | CYP4F2 (0.40) | SMN1; SMN2EGFRKDM4EKMT2ACYP4F2 | |
| SCHEMBL27373221 | 0.70 | KDM4E (0.44) | SMN1; SMN2EGFRKDM4EKMT2ACYP4F2 | |
| SCHEMBL3171866 | 0.70 | KDM4E (0.45) | SMN1; SMN2KDM4EKMT2ACYP4F2CYP4A11 | |
| SCHEMBL30755391 | 0.70 | KDM4E (0.44) | SMN1; SMN2EGFRKDM4EKMT2ACYP4F2 | |
| SCHEMBL23270679 | 0.69 | SMN1; SMN2 (0.50) | SMN1; SMN2EGFRKDM4EKMT2AMAPT | |
| SCHEMBL3641015 | 0.69 | KDM4E (0.39) | SMN1; SMN2EGFRKDM4EKMT2AMAPT | |
| SCHEMBL14856834 | 0.68 | GPR84 (0.41) | SMN1; SMN2KDM4EMAPTGAAALDH1A1 |
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-2978425-A2 | FACTOR XIa INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2016-02-03 | — | — | EP | disclosed |
| WO-2014160592-A2 | FACTOR XIa INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2014-10-02 | — | — | WO | disclosed |