Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 1/20 | 0.41 |
| ▸ | BACE1 | P56817 | 1/20 | 0.37 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.32 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.32 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.32 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.32 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.32 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | SRC | P12931 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL4664442 | 0.88 | EGFR (0.38) | DHFRBACE1GPR84TRPA1ALDH1A1 | |
| SCHEMBL12802185 | 0.83 | ALDH1A1 (0.48) | DHFRALDH1A1LMNAMAPTSMN1; SMN2 | |
| SCHEMBL4765688 | 0.83 | DHFR (0.36) | DHFRBACE1ALDH1A1MAPTCA2 | |
| SCHEMBL13586648 | 0.81 | TRPA1 (0.47) | BACE1TRPA1ALDH1A1LMNAMAPT | |
| SCHEMBL6181671 | 0.81 | BACE1 (0.38) | DHFRBACE1LMNAMAPTSMN1; SMN2 | |
| SCHEMBL4706066 | 0.81 | BACE1 (0.59) | BACE1TRPA1ALDH1A1LMNAMAPT | |
| SCHEMBL6180538 | 0.81 | KDM4C (0.34) | BACE1LMNAMAPTMAPK1L3MBTL1 | |
| SCHEMBL444673 | 0.80 | TRPA1 (0.48) | DHFRBACE1TRPA1ALDH1A1LMNA | |
| Formic Acid SCHEMBL28752897 | 0.80 | TRPA1 (0.45) | DHFRBACE1GPR84TRPA1ALDH1A1 | |
| SCHEMBL10225859 | 0.78 | SRC (0.41) | ALDH1A1LMNAMAPTSMN1; SMN2SRC |
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-1529038-A1 | BENZOTHIAZOLE DERIVATIVES HAVING BETA-2-ADRENORECEPTOR AGONIST ACTIVITY | Novartis AG (CH) | 2005-05-11 | — | — | EP | disclosed |
| WO-2004016601-A1 | BENZOTHIAZOLE DERIVATIVES HAVING BETA-2-ADRENORECEPTOR AGONIST ACTIVITY | NOVARTIS AG (CH) | 2004-02-26 | — | — | WO | disclosed |