Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | CCKBR | P32239 | 11/20 | 0.41 |
| ▸ | CCKAR | P32238 | 2/20 | 0.41 |
| ▸ | BDKRB1 | P46663 | 6/20 | 0.40 |
| ▸ | OXTR | P30559 | 1/20 | 0.38 |
| ▸ | PTH1R | Q03431 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9008757 | 1.00 | ALDH1A1 (0.42) | ALDH1A1LMNAMAPTSMN1; SMN2CCKBR | |
| SCHEMBL9008759 | 1.00 | ALDH1A1 (0.42) | ALDH1A1LMNAMAPTSMN1; SMN2CCKBR | |
| SCHEMBL9302357 | 0.86 | BDKRB1 (0.42) | ALDH1A1CCKBRCCKARBDKRB1 | |
| SCHEMBL9302353 | 0.86 | BDKRB1 (0.42) | ALDH1A1CCKBRCCKARBDKRB1 | |
| SCHEMBL9302361 | 0.86 | BDKRB1 (0.42) | ALDH1A1CCKBRCCKARBDKRB1 | |
| SCHEMBL9008746 | 0.85 | BDKRB1 (0.52) | ALDH1A1MAPTCCKBRCCKARBDKRB1 | |
| SCHEMBL9008739 | 0.85 | BDKRB1 (0.52) | ALDH1A1MAPTCCKBRCCKARBDKRB1 | |
| SCHEMBL9008741 | 0.85 | BDKRB1 (0.52) | ALDH1A1MAPTCCKBRCCKARBDKRB1 | |
| SCHEMBL9302487 | 0.84 | BDKRB1 (0.51) | CCKBRCCKARBDKRB1 | |
| SCHEMBL9302478 | 0.84 | BDKRB1 (0.51) | CCKBRCCKARBDKRB1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5556969-A | Benzodiazepine derivatives | MERCK SHARP & DOHME LTD. (GB) | 1996-09-17 | — | — | US | disclosed |