Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.33 |
| ▸ | CTSL | P07711 | 1/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.32 |
| ▸ | HPGD | P15428 | 3/20 | 0.32 |
| ▸ | TSHR | P16473 | 3/20 | 0.32 |
| ▸ | HTT | P42858 | 3/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | PKM | P14618 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.32 |
| ▸ | XBP1 | P17861 | 2/20 | 0.32 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.32 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7708478 | 0.97 | HSD17B10 (0.35) | HSD17B10CTSLS1PR3ALDH1A1HPGD | |
| SCHEMBL7092472 | 0.91 | HSD17B10 (0.37) | HSD17B10CTSLPARP1ALDH1A1HPGD | |
| SCHEMBL7713423 | 0.91 | PARP1 (0.41) | HSD17B10CTSLPARP1ALDH1A1TSHR | |
| SCHEMBL7708252 | 0.89 | CTSL (0.45) | HSD17B10CTSLALDH1A1HPGDTSHR | |
| SCHEMBL7095640 | 0.89 | ALDH1A1 (0.37) | HSD17B10ALDH1A1HPGDTSHRHTT | |
| SCHEMBL7087725 | 0.88 | CTSS (0.41) | HSD17B10ALDH1A1HPGDTSHRHTT | |
| SCHEMBL7704943 | 0.88 | ALDH1A1 (0.43) | HSD17B10CTSLPARP1ALDH1A1HPGD | |
| SCHEMBL7711322 | 0.87 | MEN1 (0.38) | ALDH1A1HPGDHTTKDM4ERAB9A | |
| SCHEMBL7094044 | 0.87 | SMN1; SMN2 (0.40) | HSD17B10ALDH1A1HPGDTSHRHTT | |
| SCHEMBL7708475 | 0.87 | — | — |
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 1 patent. 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 |