Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMPD1 | P17405 | 3/20 | 0.60 |
| ▸ | LPAR3 | Q9UBY5 | 8/20 | 0.43 |
| ▸ | LPAR1 | Q92633 | 6/20 | 0.43 |
| ▸ | LPAR5 | Q9H1C0 | 1/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | LPAR2 | Q9HBW0 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | FDPS | P14324 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2422956 | 0.83 | SMPD1 (0.57) | SMPD1LPAR3LPAR1LPAR5PTPN1 | |
| SCHEMBL11352600 | 0.82 | LPAR3 (0.54) | SMPD1LPAR3LPAR1LPAR5LPAR2 | |
| SCHEMBL2049378 | 0.80 | SMPD1 (0.56) | SMPD1LPAR3LPAR1LPAR5PTPN1 | |
| SCHEMBL11044258 | 0.78 | SMPD1 (0.42) | SMPD1LPAR3LPAR1LPAR5LPAR2 | |
| SCHEMBL21291940 | 0.76 | SMPD1 (0.51) | SMPD1LPAR3LPAR1LPAR5PTPN1 | |
| SCHEMBL28837485 | 0.76 | SMPD1 (0.77) | SMPD1LPAR3LPAR1PTPN1LPAR2 | |
| SCHEMBL28837479 | 0.76 | SMPD1 (0.77) | SMPD1LPAR3LPAR1PTPN1LPAR2 | |
| SCHEMBL6271516 | 0.74 | CYP3A4 (0.45) | SMPD1LPAR3LPAR1CYP3A4TSHR | |
| SCHEMBL21291922 | 0.73 | SMPD1 (0.62) | SMPD1LPAR3LPAR1LPAR5PTPN1 | |
| SCHEMBL2380001 | 0.73 | SMPD1 (0.62) | SMPD1LPAR3LPAR1LPAR5PTPN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112088043-A | Compounds for coordination with metals, compositions containing such compounds and methods of catalyzing reactions | PPG工业俄亥俄公司 | 2020-12-15 | — | — | CN | disclosed |