Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.47 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | TTR | P02766 | 1/20 | 0.44 |
| ▸ | CES1 | P23141 | 1/20 | 0.44 |
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
| ▸ | MAPK7 | Q13164 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9102280 | 0.88 | TP53 (0.52) | NR1H2NR1H3TP53TTRCES1 | |
| SCHEMBL8936687 | 0.82 | NR1H2 (0.44) | NR1H2NR1H3TP53BRD4LMNA | |
| SCHEMBL9853427 | 0.79 | TP53 (0.48) | TP53LMNASMN1; SMN2ALDH1A1POLB | |
| SCHEMBL14288741 | 0.79 | NR1H2 (0.58) | NR1H2NR1H3TTRCES1BRD4 | |
| SCHEMBL8936669 | 0.78 | TP53 (0.46) | TP53LMNASMN1; SMN2POLBTDP1 | |
| SCHEMBL8936648 | 0.77 | TP53 (0.45) | TP53LMNASMN1; SMN2ALDH1A1POLB | |
| SCHEMBL8936730 | 0.77 | TP53 (0.53) | TP53ALDH1A1POLBKMT2AMAPT | |
| SCHEMBL8936654 | 0.77 | TP53 (0.45) | TP53LMNASMN1; SMN2ALDH1A1POLB | |
| SCHEMBL16065742 | 0.75 | MAPK7 (0.45) | NR1H2NR1H3TTRCES1BRD4 | |
| SCHEMBL9101978 | 0.75 | MAPT (0.53) | LMNASMN1; SMN2POLBKMT2AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0417534-A1 | Pyrido[2,3-b][1,4]benzoxazepin (and thiazepin)-6(5H)-ones and thiones and their use in the prevention or treatment of AIDS | Boehringer Ingelheim Pharmaceuticals Inc. (US) | 1991-03-20 | — | — | EP | disclosed |