Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | DRD1 | P21728 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8104253 | 0.79 | CYP2C19 (0.32) | CYP2C19 | |
| SCHEMBL13908972 | 0.77 | CYP3A4 (0.42) | CYP3A4TDP1DRD1 | |
| SCHEMBL503707 | 0.72 | CYP3A4 (0.46) | CYP3A4TDP1DRD1 | |
| SCHEMBL29809925 | 0.72 | CYP3A4 (0.46) | CYP3A4TDP1DRD1 | |
| SCHEMBL27880843 | 0.72 | CYP3A4 (0.41) | CYP3A4TDP1DRD1 | |
| SCHEMBL13908975 | 0.71 | NFE2L2 (0.54) | CYP3A4TDP1CYP2C19 | |
| SCHEMBL13091168 | 0.70 | LMNA (0.30) | DRD1 | |
| SCHEMBL2850053 | 0.69 | TDP1 (0.42) | CYP3A4TDP1DRD1 | |
| SCHEMBL28176536 | 0.69 | CYP3A4 (0.42) | CYP3A4TDP1DRD1 | |
| SCHEMBL13908991 | 0.69 | ALOX5 (0.45) | CYP3A4TDP1DRD1 |
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-6103867-A | METAL COMPLEX MIXED WITH LEWIS AND/OR PROTIC ACIDS; SIMPLIFICATION, EFFICIENCY, HALOGEN-FREE STARTING MATERIALS | BASF AKTIENGESELLSCHAFT (DE) | 2000-08-15 | — | — | US | disclosed |