Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.58 |
| ▸ | LPAR3 | Q9UBY5 | 8/20 | 0.55 |
| ▸ | LPAR2 | Q9HBW0 | 6/20 | 0.55 |
| ▸ | LPAR1 | Q92633 | 3/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | CDC25A | P30304 | 1/20 | 0.44 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.44 |
| ▸ | AKT1 | P31749 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28323950 | 1.00 | CYP3A4 (0.58) | CYP3A4LPAR3LPAR2LPAR1TSHR | |
| SCHEMBL18114320 | 0.98 | CYP3A4 (0.60) | CYP3A4LPAR3LPAR2LPAR1TSHR | |
| Methane SCHEMBL27596418 | 0.87 | CYP3A4 (0.76) | CYP3A4LPAR3LPAR2LPAR1TSHR | |
| Methane SCHEMBL28414806 | 0.87 | CYP3A4 (0.76) | CYP3A4LPAR3LPAR2LPAR1TSHR | |
| SCHEMBL7183824 | 0.84 | CYP3A4 (0.80) | CYP3A4LPAR3LPAR2LPAR1TSHR | |
| SCHEMBL21440331 | 0.84 | CYP3A4 (0.80) | CYP3A4LPAR3LPAR2LPAR1TSHR | |
| SCHEMBL10608661 | 0.84 | CYP3A4 (0.80) | CYP3A4LPAR3LPAR2LPAR1TSHR | |
| SCHEMBL20483847 | 0.84 | CYP3A4 (0.80) | CYP3A4LPAR3LPAR2LPAR1TSHR | |
| SCHEMBL21437266 | 0.84 | CYP3A4 (0.80) | CYP3A4LPAR3LPAR2LPAR1TSHR | |
| SCHEMBL8040341 | 0.84 | CYP3A4 (0.80) | CYP3A4LPAR3LPAR2LPAR1TSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104151350-B | The synthetic method of oral cavity binder methacryl decyl dihydrogen phosphoric acid ester | CHANGCHUN POLYTECHNIC UNIV. (CN) | 2016-05-04 | — | — | CN | claimed |
| CN-104151350-B | The synthetic method of oral cavity binder methacryl decyl dihydrogen phosphoric acid ester | CHANGCHUN POLYTECHNIC UNIV. (CN) | 2016-05-04 | — | — | CN | disclosed |
| CN-104151350-B | The synthetic method of oral cavity binder methacryl decyl dihydrogen phosphoric acid ester | CHANGCHUN POLYTECHNIC UNIV. (CN) | 2016-05-04 | — | — | CN | disclosed |