Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 8/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | BRD2 | P25440 | 1/20 | 0.35 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.35 |
| ▸ | BRDT | Q58F21 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL15803815 | 0.85 | ELANE (0.44) | ELANESMN1; SMN2PARP1ALDH1A1BRD4 | |
| SCHEMBL20338739 | 0.84 | HSD17B10 (0.47) | ELANENPSR1SMN1; SMN2PARP1ALDH1A1 | |
| SCHEMBL16806644 | 0.82 | NPSR1 (0.46) | NPSR1GRIN2BSMN1; SMN2GRIN1 | |
| SCHEMBL197253 | 0.80 | ELANE (0.49) | ELANESMN1; SMN2PARP1ALDH1A1BRD4 | |
| SCHEMBL7021949 | 0.80 | ELANE (0.49) | ELANESMN1; SMN2PARP1ALDH1A1BRD4 | |
| SCHEMBL3911656 | 0.78 | ALDH1A1 (0.50) | ELANESMN1; SMN2ALDH1A1 | |
| SCHEMBL8649103 | 0.77 | ELANE (0.51) | ELANESMN1; SMN2L3MBTL1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL20944983 | 0.76 | ELANE (0.50) | ELANESMN1; SMN2L3MBTL1ALDH1A1 | |
| SCHEMBL3713978 | 0.76 | RAD52 (0.52) | ELANENPSR1GRIN2BSMN1; SMN2L3MBTL1 | |
| SCHEMBL25530737 | 0.75 | ELANE (0.45) | ELANESMN1; SMN2PARP1ALDH1A1BRD4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2014091265-A1 | PYRIMIDINE-2,4-DIAMINE DERIVATIVES AS KINASE INHIBITORS | AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) | 2014-06-19 | — | — | WO | disclosed |
| WO-2010131147-A1 | CYCLOBUTENEDIONE DERIVATIVES | PFIZER LIMITED (GB) | 2010-11-18 | — | — | WO | disclosed |
| WO-2010131147-A1 | CYCLOBUTENEDIONE DERIVATIVES | PFIZER LIMITED (GB) | 2010-11-18 | — | — | WO | disclosed |