Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.55 |
| ▸ | AKR1B1 | P15121 | 4/20 | 0.53 |
| ▸ | AKR1A1 | P14550 | 2/20 | 0.53 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.42 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.41 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL28984554 | 0.88 | AKR1A1 (0.53) | HDAC6AKR1B1AKR1A1PTGDR2SMN1; SMN2 | |
| SCHEMBL6229545 | 0.86 | SMN1; SMN2 (0.56) | HDAC6AKR1B1AKR1A1PTGDR2SMN1; SMN2 | |
| SCHEMBL28201449 | 0.81 | HDAC6 (0.49) | HDAC6KMT2ANPC1RAB9AMAPT | |
| SCHEMBL2956510 | 0.81 | LOXL2 (0.62) | HDAC6AKR1B1AKR1A1PTGDR2SMN1; SMN2 | |
| SCHEMBL5074923 | 0.81 | AKR1B1 (0.46) | HDAC6AKR1B1AKR1A1SMN1; SMN2KMT2A | |
| SCHEMBL28984547 | 0.81 | MAPT (0.47) | HDAC6AKR1B1AKR1A1PTGDR2SMN1; SMN2 | |
| SCHEMBL3190308 | 0.81 | KDM4E (0.51) | HDAC6AKR1B1AKR1A1SMN1; SMN2KMT2A | |
| SCHEMBL9306082 | 0.81 | SMN1; SMN2 (0.61) | HDAC6SMN1; SMN2KMT2ANPC1RAB9A | |
| Hydrochloric Acid SCHEMBL3898824 | 0.80 | KDM4E (0.50) | HDAC6AKR1B1AKR1A1SMN1; SMN2KMT2A | |
| SCHEMBL1127709 | 0.80 | UBE2T (0.61) | SMN1; SMN2KMT2ANPC1RAB9ASLC5A2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110845439-B | Method for synthesizing 2-substituted benzothiazole by one-pot method | 南京工业大学 | 2023-04-11 | — | — | CN | disclosed |
| CN-110845439-A | Method for synthesizing 2-substituted benzothiazole by one-pot method | 南京工业大学 | 2020-02-28 | — | — | CN | disclosed |