Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.53 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | IDO1 | P14902 | 2/20 | 0.50 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.47 |
| ▸ | CTSB | P07858 | 1/20 | 0.45 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL4823936 | 0.83 | KDM4E (0.47) | ALDH1A1TDP1POLBSMN1; SMN2KDM4E | |
| SCHEMBL28104285 | 0.81 | SMN1; SMN2 (0.48) | ALDH1A1IDO1TAAR1SMN1; SMN2MAPT | |
| SCHEMBL28835144 | 0.81 | RAB9A (0.53) | ALDH1A1TDP1IDO1TAAR1SMN1; SMN2 | |
| SCHEMBL16242574 | 0.80 | POLB (0.68) | ALDH1A1POLBSMN1; SMN2MAPTKMT2A | |
| SCHEMBL16242814 | 0.78 | POLB (0.65) | ALDH1A1POLBSMN1; SMN2MAPTKMT2A | |
| SCHEMBL8495432 | 0.78 | METAP2 (0.47) | ALDH1A1POLBIDO1TAAR1SMN1; SMN2 | |
| SCHEMBL8611008 | 0.78 | SMN1; SMN2 (0.55) | ALDH1A1TDP1IDO1TAAR1SMN1; SMN2 | |
| SCHEMBL7341529 | 0.77 | IDO1 (0.55) | ALDH1A1IDO1TAAR1SMN1; SMN2MAPT | |
| SCHEMBL28403191 | 0.77 | IDO1 (0.55) | ALDH1A1IDO1TAAR1SMN1; SMN2MAPT | |
| SCHEMBL1341389 | 0.76 | ALDH1A1 (0.59) | ALDH1A1ADRA2BPTGS1TDP1IDO1 |
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-105646396-B | A kind of synthetic method of benzothiazole derivant | 上海应用技术学院 | 2018-09-14 | — | — | CN | disclosed |
| CN-105646396-A | Method for synthesizing benzothiazole derivatives | 上海应用技术学院 | 2016-06-08 | — | — | CN | disclosed |