Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2B | P41595 | 2/20 | 0.40 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 6/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 4/20 | 0.32 |
| ▸ | DRD4 | P21917 | 3/20 | 0.32 |
| ▸ | HTR7 | P34969 | 1/20 | 0.32 |
| ▸ | XIAP | P98170 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL13730382 | 0.64 | DRD2 (0.39) | HTR2BTMEM97SIGMAR1DRD2HTR2C | |
| SCHEMBL21655317 | 0.61 | KDM4C (0.43) | MEN1NPC1USP2KMT2A | |
| SCHEMBL25675893 | 0.61 | KDM4C (0.43) | MEN1NPC1USP2KMT2A | |
| SCHEMBL9508981 | 0.59 | ALDH1A1 (0.45) | DRD2KDM4EMEN1NPC1USP2 | |
| SCHEMBL9511405 | 0.59 | ALDH1A1 (0.45) | DRD2KDM4EMEN1NPC1USP2 | |
| SCHEMBL21120521 | 0.59 | DRD2 (0.35) | DRD2KDM4EMEN1NPC1USP2 | |
| SCHEMBL24444333 | 0.59 | MEN1 (0.44) | HTR2BHTR2CKDM4EMEN1NPC1 | |
| Biphenyl SCHEMBL323849 | 0.59 | ALDH1A1 (0.69) | NPC1ALDH1A1MAPTHPGDSMN1; SMN2 | |
| Biphenyl SCHEMBL27803316 | 0.58 | ALDH1A1 (0.50) | ALDH1A1MAPTHPGDSMN1; SMN2 | |
| SCHEMBL24900236 | 0.58 | MAOA (0.40) | KDM4EMEN1USP2ALDH1A1MAPT |
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-1515567-A | Novel benzothiepines having activity as inhibitors of ileal bile acid transport and taurocholate uptake | G.D.ɪ����˾ | 2004-07-28 | — | — | CN | disclosed |
| CN-1110494-C | Novel benzothiepines having activity as inhibitors of ileal bile acid transport and taurocholate uptake | SEARLE & CO (US) | 2003-06-04 | — | — | CN | disclosed |
| CN-1221414-A | Novel benzothiepines having activity as inhibitors of ileal bile acid transport and taurocholate uptake | SEARLE & CO (US) | 1999-06-30 | — | — | CN | disclosed |