Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTBP2 | P56545 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | CTSL | P07711 | 1/20 | 0.44 |
| ▸ | MGLL | Q99685 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | XDH | P47989 | 3/20 | 0.42 |
| ▸ | TLR4 | O00206 | 1/20 | 0.42 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.40 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4586337 | 0.93 | ALDH1A1 (0.51) | CTBP2SMN1; SMN2KDM4EALDH1A1RAB9A | |
| SCHEMBL4586342 | 0.93 | ALDH1A1 (0.51) | CTBP2SMN1; SMN2KDM4EALDH1A1RAB9A | |
| SCHEMBL8865628 | 0.90 | SMN1; SMN2 (0.59) | CTBP2SMN1; SMN2KDM4EALDH1A1L3MBTL1 | |
| SCHEMBL7423263 | 0.90 | SMN1; SMN2 (0.59) | CTBP2SMN1; SMN2KDM4EALDH1A1L3MBTL1 | |
| SCHEMBL4586154 | 0.86 | CTSL (0.55) | CTBP2SMN1; SMN2KDM4ECTSLMGLL | |
| SCHEMBL257218 | 0.86 | CTSL (0.55) | CTBP2SMN1; SMN2KDM4ECTSLMGLL | |
| SCHEMBL4586157 | 0.86 | CTSL (0.55) | CTBP2SMN1; SMN2KDM4ECTSLMGLL | |
| SCHEMBL28302059 | 0.83 | LMNA (0.52) | CTBP2SMN1; SMN2KDM4EALDH1A1CTSL | |
| SCHEMBL4459267 | 0.82 | L3MBTL1 (0.47) | CTBP2SMN1; SMN2KDM4EALDH1A1RAB9A | |
| SCHEMBL4459265 | 0.82 | L3MBTL1 (0.47) | CTBP2SMN1; SMN2KDM4EALDH1A1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-109705146-A | 2- amino benzo [4,5] thieno [3,2-d] thiazole, derivative and its synthetic method | 湘潭大学 | 2019-05-03 | — | — | CN | claimed |