Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | TTR | P02766 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 2/20 | 0.41 |
| ▸ | MAOB | P27338 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.40 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6821174 | 1.00 | BACE1 (0.47) | BACE1MAPTALDH1A1L3MBTL1KDM4E | |
| SCHEMBL28448735 | 1.00 | BACE1 (0.47) | BACE1MAPTALDH1A1L3MBTL1KDM4E | |
| SCHEMBL12785434 | 0.88 | BACE1 (0.41) | BACE1MAPTALDH1A1L3MBTL1KDM4E | |
| SCHEMBL1167315 | 0.86 | TDO2 (0.54) | BACE1MAPTALDH1A1L3MBTL1KDM4E | |
| SCHEMBL1167316 | 0.86 | TDO2 (0.54) | BACE1MAPTALDH1A1L3MBTL1KDM4E | |
| SCHEMBL30632999 | 0.86 | TDO2 (0.54) | BACE1MAPTALDH1A1L3MBTL1KDM4E | |
| SCHEMBL8148557 | 0.84 | MAPT (0.47) | BACE1MAPTALDH1A1L3MBTL1KDM4E | |
| SCHEMBL8148561 | 0.84 | MAPT (0.47) | BACE1MAPTALDH1A1L3MBTL1KDM4E | |
| Hydrochloric Acid SCHEMBL6821177 | 0.84 | TDO2 (0.53) | BACE1MAPTALDH1A1L3MBTL1KDM4E | |
| SCHEMBL6822228 | 0.84 | CYP1A1 (0.55) | CYP1A1CYP1B1 |
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 |