Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1D1 | P20393 | 4/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | NR1H3 | Q13133 | 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 | |
|---|---|---|---|---|
| SCHEMBL6534683 | 0.95 | NR1D1 (0.34) | NR1D1CYP1A2NR1H3 | |
| SCHEMBL422349 | 0.91 | CHRM2 (0.36) | NR1D1CYP1A2NR1H3 | |
| SCHEMBL7564036 | 0.91 | NR1D1 (0.36) | NR1D1NR1H3 | |
| SCHEMBL2185396 | 0.87 | NR1D1 (0.35) | NR1D1NR1H3 | |
| Hydrochloric Acid SCHEMBL6840742 | 0.85 | NR1D1 (0.34) | NR1D1NR1H3 | |
| SCHEMBL8412077 | 0.84 | NR1D1 (0.34) | NR1D1NR1H3 | |
| SCHEMBL18362362 | 0.83 | NR1D1 (0.33) | NR1D1NR1H3 | |
| SCHEMBL2185399 | 0.81 | TDP1 (0.43) | NR1D1NR1H3 | |
| SCHEMBL21548073 | 0.81 | NR1D1 (0.33) | NR1D1NR1H3 | |
| SCHEMBL19458 | 0.81 | TDP1 (0.42) | NR1D1NR1H3 |
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-1163247-A1 | PHARMACEUTICAL COMPOSITIONS COMPRISING METAL COMPLEXES | ANORMED INC. (CA) | 2001-12-19 | — | — | EP | disclosed |
| WO-2000056743-A1 | PHARMACEUTICAL COMPOSITIONS COMPRISING METAL COMPLEXES | ANORMED INC. (CA) | 2000-09-28 | — | — | WO | disclosed |