Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A1 | P18405 | 3/20 | 0.41 |
| ▸ | SRD5A2 | P31213 | 3/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | AHR | P35869 | 3/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | KMO | O15229 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6821138 | 0.89 | AHR (0.38) | SRD5A1SRD5A2HSP90AA1NOTUMAHR | |
| SCHEMBL13692384 | 0.86 | NOTUM (0.38) | SRD5A1SRD5A2HSP90AA1NOTUMALDH1A1 | |
| SCHEMBL13689265 | 0.82 | CA12 (0.35) | SRD5A1SRD5A2NOTUMTSHRALDH1A1 | |
| SCHEMBL13687525 | 0.81 | MEN1 (0.38) | SRD5A1SRD5A2HSP90AA1NOTUMALDH1A1 | |
| SCHEMBL212723 | 0.76 | MAOA (0.42) | SRD5A1SRD5A2NOTUMTSHRALDH1A1 | |
| SCHEMBL16397646 | 0.76 | MAOA (0.42) | SRD5A1SRD5A2NOTUMTSHRALDH1A1 | |
| SCHEMBL14267965 | 0.73 | AHR (0.38) | ALDH1A1TP53AHRALOX15CMA1 | |
| SCHEMBL8626958 | 0.72 | AHR (0.38) | AHRCMA1HTT | |
| SCHEMBL11809222 | 0.69 | POLB (0.46) | SRD5A1SRD5A2HSP90AA1NOTUMKMO | |
| SCHEMBL14864585 | 0.68 | NOTUM (0.36) | NOTUMTSHRALDH1A1SMN1; SMN2CA12 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004046122-A2 | BENZOXAZOLE, BENZTHIAZOLE AND BENZIMIDAZOLE ACID DERIVATIVES AND THEIR USE AS HEPARANASE INHIBITORS | OXFORD GLYCOSCIENCES (UK) LTD (GB) | 2004-06-03 | — | — | WO | disclosed |