Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL2877352 | 0.93 | CYP3A4 (0.67) | CYP3A4TSHRCYP1A2TRPA1MAPK1 | |
| SCHEMBL16417864 | 0.93 | CYP3A4 (0.67) | CYP3A4TSHRCYP1A2TRPA1MAPK1 | |
| SCHEMBL3024606 | 0.93 | CYP3A4 (0.67) | CYP3A4TSHRCYP1A2TRPA1MAPK1 | |
| SCHEMBL374837 | 0.85 | CYP3A4 (0.63) | CYP3A4TSHRCYP1A2TRPA1MAPK1 | |
| SCHEMBL1104238 | 0.84 | CYP3A4 (0.80) | CYP3A4TSHRCYP1A2TRPA1MAPK1 | |
| SCHEMBL1396314 | 0.84 | CYP3A4 (0.54) | CYP3A4TSHRCYP1A2TRPA1MAPK1 | |
| SCHEMBL10635526 | 0.84 | CYP3A4 (0.62) | CYP3A4TSHRCYP1A2TRPA1MAPK1 | |
| SCHEMBL11345977 | 0.83 | CYP3A4 (0.57) | CYP3A4TSHRCYP1A2TRPA1MAPK1 | |
| SCHEMBL19598808 | 0.82 | CYP3A4 (0.51) | CYP3A4TSHRCYP1A2TRPA1 | |
| SCHEMBL13743147 | 0.82 | CYP3A4 (0.65) | CYP3A4TSHRCYP1A2TRPA1MAPK1 |
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-20150148449-A1 | Polyurethane-based Waterproofing Composition for the Water-proofing of Concrete Structures | VERIFI LLC | 2015-05-28 | — | — | US | disclosed |