Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.33 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | AKT1 | P31749 | 2/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7710846 | 0.90 | PARP1 (0.53) | PARP1HSD17B10ALOX15ALDH1A1MAPK1 | |
| SCHEMBL7710837 | 0.86 | PARP1 (0.40) | PARP1HSD17B10ALOX15HDAC3HDAC1 | |
| SCHEMBL7704945 | 0.85 | HDAC3 (0.44) | PARP1HSD17B10ALOX15HDAC3HDAC1 | |
| SCHEMBL7088859 | 0.84 | PARP1 (0.37) | PARP1HSD17B10ALOX15HDAC3HDAC1 | |
| SCHEMBL6309617 | 0.84 | HDAC1 (0.43) | PARP1HSD17B10ALOX15HDAC3HDAC1 | |
| SCHEMBL6995053 | 0.80 | POLB (0.34) | PARP1HSD17B10ALOX15HDAC3HDAC1 | |
| SCHEMBL7704961 | 0.79 | HDAC3 (0.33) | HSD17B10HDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL5472790 | 0.78 | PARP1 (0.36) | PARP1HSD17B10HDAC3HDAC1HDAC2 | |
| SCHEMBL7704907 | 0.78 | HSD17B10 (0.38) | PARP1HSD17B10ALOX15HDAC3HDAC1 | |
| SCHEMBL6304956 | 0.78 | BRD4 (0.41) | PARP1HSD17B10HDAC3HDAC1HDAC2 |
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-1015437-B1 | BENZOXAZINE AND BENZOTHIAZINE DERIVATIVES AND THEIR USE IN PHARMACEUTICALS | SCHERING AG (DE) | 2003-12-03 | — | — | EP | disclosed |
| US-6365736-B1 | TREATMENT OF NERVOUS SYSTEM DISORDERS, CARDIOVASCULAR DISORDERS AND FOR ACTIVITY AS NO-SYNTHASES (NOS) INHIBITORS. | SCHERING AKTIENGESELLSCHAFT (DE) | 2002-04-02 | — | — | US | disclosed |