Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | P2RY6 | Q15077 | 1/20 | 0.33 |
| ▸ | STS | P08842 | 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 | |
|---|---|---|---|---|
| SCHEMBL25873142 | 0.97 | CYP3A4 (0.57) | CYP3A4TSHRCYP1A2MAPK1TDP1 | |
| SCHEMBL34881 | 0.95 | CYP3A4 (0.67) | CYP3A4TSHRCYP1A2MAPK1TDP1 | |
| SCHEMBL14826119 | 0.95 | CYP3A4 (0.67) | CYP3A4TSHRCYP1A2MAPK1TDP1 | |
| SCHEMBL821348 | 0.91 | CYP3A4 (0.61) | CYP3A4TSHRCYP1A2MAPK1TDP1 | |
| SCHEMBL25873097 | 0.91 | CYP3A4 (0.61) | CYP3A4TSHRCYP1A2MAPK1TDP1 | |
| SCHEMBL16383177 | 0.88 | CYP3A4 (0.53) | CYP3A4TSHRCYP1A2MAPK1TDP1 | |
| SCHEMBL16383172 | 0.86 | CYP3A4 (0.52) | CYP3A4TSHRCYP1A2MAPK1TDP1 | |
| SCHEMBL17861694 | 0.85 | CYP3A4 (0.50) | CYP3A4TSHRCYP1A2TRPA1 | |
| SCHEMBL16417487 | 0.85 | CYP3A4 (0.50) | CYP3A4TSHRCYP1A2TRPA1 | |
| SCHEMBL12386442 | 0.85 | CYP3A4 (0.50) | CYP3A4TSHRCYP1A2TRPA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20240016699-A1 | PHARMACEUTICAL PACKAGES WITH COATINGS COMPRISING POLYCYANURATES | CORNING INC (US) | 2024-01-18 | — | — | US | disclosed |
| US-11707411-B2 | Pharmaceutical packages with coatings comprising polycyanurates | CORNING INCORPORATED (US) | 2023-07-25 | — | — | US | disclosed |