Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.36 |
| ▸ | ELANE | P08246 | 2/20 | 0.36 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MITF | O75030 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL23456707 | 1.00 | ALDH1A1 (0.36) | ALDH1A1ELANESIRT1SLC6A2LMNA | |
| SCHEMBL23456695 | 0.92 | SLC6A2 (0.36) | ALDH1A1ELANESIRT1SLC6A2LMNA | |
| SCHEMBL29694602 | 0.92 | SLC6A2 (0.36) | ALDH1A1ELANESIRT1SLC6A2LMNA | |
| SCHEMBL29694594 | 0.90 | ELANE (0.39) | ALDH1A1ELANESIRT1SLC6A2LMNA | |
| SCHEMBL22286506 | 0.90 | ELANE (0.39) | ALDH1A1ELANESIRT1SLC6A2LMNA | |
| SCHEMBL30912761 | 0.88 | SLC6A2 (0.39) | ALDH1A1ELANESIRT1SLC6A2LMNA | |
| SCHEMBL23476354 | 0.88 | MEN1 (0.37) | ALDH1A1ELANESLC6A2LMNAMAPT | |
| SCHEMBL21585978 | 0.88 | SLC6A2 (0.39) | ALDH1A1ELANESIRT1SLC6A2LMNA | |
| SCHEMBL23456691 | 0.88 | ELANE (0.36) | ALDH1A1ELANESLC6A2MAPTHSD17B10 | |
| SCHEMBL22286445 | 0.85 | SLC6A2 (0.40) | ALDH1A1ELANESLC6A2LMNACYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4069359-A1 | BENZOTHIA(DI)AZEPINE COMPOUNDS AND THEIR USE AS BILE ACID MODULATORS | Albireo AB (SE) | 2022-10-12 | — | — | EP | disclosed |
| CN-114786772-A | Benzothia (di) azepin compounds and their use as bile acid modulators | 阿尔比里奥公司 | 2022-07-22 | — | — | CN | disclosed |