Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.54 |
| ▸ | LPAR3 | Q9UBY5 | 8/20 | 0.52 |
| ▸ | LPAR2 | Q9HBW0 | 6/20 | 0.52 |
| ▸ | LPAR1 | Q92633 | 3/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL18614738 | 0.94 | LPAR3 (0.61) | CYP3A4LPAR3LPAR2LPAR1 | |
| SCHEMBL8022735 | 0.92 | LPAR3 (0.64) | LPAR3LPAR2LPAR1TSHRALDH1A1 | |
| SCHEMBL16996792 | 0.83 | CYP3A4 (0.54) | CYP3A4LPAR3LPAR2LPAR1TSHR | |
| SCHEMBL4459738 | 0.81 | CYP3A4 (0.52) | CYP3A4LPAR3LPAR2LPAR1TSHR | |
| SCHEMBL17956594 | 0.80 | CYP3A4 (0.56) | CYP3A4LPAR3LPAR2LPAR1TSHR | |
| SCHEMBL28783278 | 0.79 | CYP3A4 (0.50) | CYP3A4LPAR3LPAR2LPAR1TSHR | |
| SCHEMBL4454773 | 0.78 | CYP3A4 (0.48) | CYP3A4LPAR3LPAR2LPAR1TSHR | |
| Bicarbonate SCHEMBL28559959 | 0.77 | CYP3A4 (0.81) | CYP3A4LPAR3LPAR2LPAR1TSHR | |
| Bicarbonate SCHEMBL28241382 | 0.77 | CYP3A4 (0.81) | CYP3A4LPAR3LPAR2LPAR1TSHR | |
| SCHEMBL16996799 | 0.77 | LPAR3 (0.61) | 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 |
|---|---|---|---|---|---|---|---|
| US-6002029-A | Antiviral prodrugs | CHIMERIX, INC. | 1999-12-14 | — | — | US | disclosed |
| US-5955452-A | LIPIDS AS VIRICIDES | ROCHE DIAGNOSTICS GMBH (DE) | 1999-09-21 | — | — | US | disclosed |
| US-5696277-A | CYTOMEGALOVIRUS, HERPES VIRUS | Hostetler, Karl Y. (US) | 1997-12-09 | — | — | US | disclosed |