Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.50 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.50 |
| ▸ | GSK3B | P49841 | 2/20 | 0.48 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 5/20 | 0.46 |
| ▸ | CES1 | P23141 | 3/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | CES2 | O00748 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | DAO | P14920 | 1/20 | 0.46 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL5143659 | 0.85 | HSP90AA1 (0.57) | HSP90AA1NTSR1GSK3BPTPN1MAPT | |
| SCHEMBL10455142 | 0.80 | CES1 (0.50) | HSP90AA1NTSR1GSK3BPTPN1MAPT | |
| SCHEMBL3523522 | 0.78 | HSP90AA1 (0.52) | HSP90AA1NTSR1GSK3BPTPN1MAPT | |
| SCHEMBL28822400 | 0.77 | VCP (0.56) | NTSR1GSK3BMAPTCES1TDP1 | |
| SCHEMBL10829674 | 0.76 | HSP90AA1 (0.50) | HSP90AA1NTSR1GSK3BPTPN1MAPT | |
| SCHEMBL6709770 | 0.76 | HSP90AA1 (0.50) | HSP90AA1NTSR1GSK3BPTPN1MAPT | |
| SCHEMBL2156158 | 0.76 | VCP (0.50) | HSP90AA1NTSR1GSK3BPTPN1MAPT | |
| SCHEMBL29136517 | 0.75 | PTPN1 (0.41) | GSK3BPTPN1MAPTCES1TDP1 | |
| SCHEMBL978641 | 0.74 | VCP (0.75) | HSP90AA1NTSR1MAPTMEN1KMT2A | |
| SCHEMBL7464184 | 0.74 | CES1 (0.55) | HSP90AA1NTSR1MAPTCES1TDP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104744493-B | 3-benzoyl-5,7-diphenyl-5H-thiazole [3,2-a] pyrimidine derivatives and application thereof | 石家庄学院 | 2017-01-25 | — | — | CN | disclosed |
| CN-104892640-A | 2-phenyl-6-benzoyl-thiazolo[3,2-b][1,2,4]-triazole derivative and application thereof | UNIV SHIJIAZHUANG | 2015-09-09 | — | — | CN | disclosed |
| CN-104744493-A | 3-benzoyl-5,7-diphenyl-5H-thiazole [3,2-a] pyrimidine derivatives and application thereof | UNIV SHIJIAZHUANG | 2015-07-01 | — | — | CN | disclosed |