Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LPAR3 | Q9UBY5 | 3/20 | 0.52 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | TYMS | P04818 | 1/20 | 0.45 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.43 |
| ▸ | S1PR2 | O95136 | 7/20 | 0.43 |
| ▸ | S1PR1 | P21453 | 7/20 | 0.43 |
| ▸ | S1PR3 | Q99500 | 7/20 | 0.43 |
| ▸ | S1PR4 | O95977 | 6/20 | 0.43 |
| ▸ | ANPEP | P15144 | 1/20 | 0.42 |
| ▸ | LAP3 | P28838 | 1/20 | 0.42 |
| ▸ | FDPS | P14324 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL55254 | 0.91 | — | — | |
| SCHEMBL28547737 | 0.88 | — | — | |
| SCHEMBL28679157 | 0.88 | — | — | |
| SCHEMBL27627928 | 0.88 | LPAR3 (0.57) | LPAR3LPAR2ALDH1A1TYMSGRM4 | |
| SCHEMBL6364192 | 0.88 | — | — | |
| Phosphoric Acid SCHEMBL4355509 | 0.88 | LPAR3 (0.57) | LPAR3LPAR2ALDH1A1TYMSGRM4 | |
| Ammonia Solution, Strong SCHEMBL9814422 | 0.88 | — | — | |
| SCHEMBL6361208 | 0.88 | — | — | |
| SCHEMBL21384981 | 0.88 | — | — | |
| Hydrochloric Acid SCHEMBL2150592 | 0.88 | — | — |
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-4100167-A | Production of 1-aminoalkane-1, 1-diphosphonic acids using phosphorous acid and nitriles in a non-aqueous system | NALCO CHEMICAL COMPANY (US) | 1978-07-11 | — | — | US | disclosed |