Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LPAR3 | Q9UBY5 | 6/20 | 0.32 |
| ▸ | LPAR2 | Q9HBW0 | 3/20 | 0.32 |
| ▸ | LPAR1 | Q92633 | 2/20 | 0.32 |
| ▸ | FDPS | P14324 | 5/20 | 0.32 |
| ▸ | LAP3 | P28838 | 1/20 | 0.32 |
| ▸ | SMPD1 | P17405 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | MMP2 | P08253 | 1/20 | 0.30 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7864131 | 0.74 | GRM4 (0.37) | FDPSKDM4EMMP2THRBMAPK1 | |
| SCHEMBL1857169 | 0.66 | — | — | |
| SCHEMBL13538617 | 0.65 | GRM4 (0.31) | GRM4 | |
| Butane SCHEMBL8632235 | 0.65 | FDPS (0.42) | LPAR3LPAR2LPAR1FDPSLAP3 | |
| Butane SCHEMBL14675942 | 0.65 | FDPS (0.42) | LPAR3LPAR2LPAR1FDPSLAP3 | |
| SCHEMBL1573316 | 0.65 | — | — | |
| SCHEMBL28969640 | 0.64 | — | — | |
| SCHEMBL1517561 | 0.64 | TPI1 (0.40) | LPAR3LPAR2LPAR1FDPSKDM4E | |
| SCHEMBL5908903 | 0.63 | SMPD1 (0.39) | LPAR3LPAR2LPAR1FDPSSMPD1 | |
| SCHEMBL28969669 | 0.63 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5312953-A | Reacting alkali/ne earth/ salt of hydroxyalkylphosphonic acid dialkyl ester with a 2-benzyloxyalkyl sulfonate, hydrogenating product, reacting with hydrogen ion acceptor and a sulfonyl chloride, reacting product with hydroxyalkylphosphonate | W. R. GRACE & CO.-CONN. (US) | 1994-05-17 | — | — | US | claimed |
| EP-0368154-A1 | Polyether bis-phosphonic acid compounds | W.R. Grace & Co.-Conn. (US) | 1990-05-16 | — | — | EP | claimed |
| US-5312953-A | Reacting alkali/ne earth/ salt of hydroxyalkylphosphonic acid dialkyl ester with a 2-benzyloxyalkyl sulfonate, hydrogenating product, reacting with hydrogen ion acceptor and a sulfonyl chloride, reacting product with hydroxyalkylphosphonate | W. R. GRACE & CO.-CONN. (US) | 1994-05-17 | — | — | US | disclosed |
| US-5266722-A | Corrosion resistance | W. R. GRACE & CO.-CONN. (US) | 1993-11-30 | — | — | US | disclosed |
| EP-0368155-B1 | INHIBITING CORROSION IN AQUEOUS SYSTEMS | W.R. Grace & Co.-Conn. (US) | 1993-04-21 | — | — | EP | disclosed |
| US-4981648-A | BIS-PHOSPHONIC ACID ETHERS | W. R. GRACE & CO.-CONN. (US) | 1991-01-01 | — | — | US | disclosed |
| EP-0368155-A1 | Inhibiting corrosion in aqueous systems | W.R. Grace & Co.-Conn. (US) | 1990-05-16 | — | — | EP | disclosed |
| EP-0368154-A1 | Polyether bis-phosphonic acid compounds | W.R. Grace & Co.-Conn. (US) | 1990-05-16 | — | — | EP | disclosed |