Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | JAK3 | P52333 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 3/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | AKT2 | P31751 | 1/20 | 0.44 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | JAK2 | O60674 | 1/20 | 0.42 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.41 |
| ▸ | BTK | Q06187 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL17623135 | 0.82 | KDM4E (0.70) | LMNAJAK3KDM4EGAAMEN1 | |
| Hydrochloric Acid SCHEMBL31737655 | 0.81 | HTR2C (0.53) | ALDH1A1KDM4EGAAHTTMEN1 | |
| SCHEMBL20145916 | 0.78 | RPS6KB1 (0.47) | ALDH1A1LMNASMN1; SMN2JAK3NPC1 | |
| SCHEMBL9159049 | 0.76 | HTT (0.61) | ALDH1A1LMNASMN1; SMN2JAK3NPC1 | |
| SCHEMBL1871559 | 0.75 | RPS6KB1 (0.50) | ALDH1A1LMNASMN1; SMN2JAK3NPC1 | |
| SCHEMBL5889244 | 0.75 | KDM4E (0.55) | LMNASMN1; SMN2JAK3KDM4EGAA | |
| SCHEMBL16071244 | 0.74 | LRRK2 (0.54) | ALDH1A1SMN1; SMN2JAK3KDM4EHTT | |
| SCHEMBL10567632 | 0.74 | LMNA (0.48) | ALDH1A1LMNASMN1; SMN2JAK3NPC1 | |
| SCHEMBL11471053 | 0.73 | HTT (0.58) | ALDH1A1LMNASMN1; SMN2JAK3NPC1 | |
| Hydrochloric Acid SCHEMBL10567357 | 0.73 | LMNA (0.47) | ALDH1A1LMNASMN1; SMN2JAK3NPC1 |
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-2117542-A1 | COMBINATIONS OF BETA- 2 -ADRENOCEPTOR AGONISTIC BENZOTHIAZOLONE | AstraZeneca AB (SE) | 2009-11-18 | — | — | EP | disclosed |
| WO-2008096111-A1 | COMBINATIONS OF BETA- 2 -ADRENOCEPTOR AGONISTIC BENZOTHIAZOLONE | ASTRAZENECA AB (SE) | 2008-08-14 | — | — | WO | disclosed |