Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MMP2 | P08253 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | TYMS | P04818 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | BLM | P54132 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | PGK1 | P00558 | 1/20 | 0.35 |
| ▸ | PGK2 | P07205 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | FDPS | P14324 | 3/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Nitrilotri(Methylphosphonic Acid) SCHEMBL21434 | 1.00 | KDM4E (0.44) | KDM4EMMP2THRBMAPK1HSD17B10 | |
| Nitrilotri(Methylphosphonic Acid) SCHEMBL452541 | 0.96 | KDM4E (0.41) | KDM4EMMP2THRBMAPK1HSD17B10 | |
| Nitrilotri(Methylphosphonic Acid) SCHEMBL3976608 | 0.96 | KDM4E (0.41) | KDM4EMMP2THRBMAPK1HSD17B10 | |
| Nitrilotri(Methylphosphonic Acid) SCHEMBL23801213 | 0.96 | KDM4E (0.41) | KDM4EMMP2THRBMAPK1HSD17B10 | |
| Nitrilotri(Methylphosphonic Acid) SCHEMBL25293314 | 0.96 | KDM4E (0.41) | KDM4EMMP2THRBMAPK1HSD17B10 | |
| SCHEMBL12250795 | 0.86 | KDM4E (0.39) | KDM4EMMP2THRBMAPK1HSD17B10 | |
| SCHEMBL22492 | 0.86 | KDM4E (0.39) | KDM4EMMP2THRBMAPK1HSD17B10 | |
| SCHEMBL13233435 | 0.85 | CA2 (0.37) | KDM4EMMP2THRBMAPK1HSD17B10 | |
| SCHEMBL5069924 | 0.85 | KDM4E (0.33) | KDM4EMMP2THRBMAPK1HSD17B10 | |
| SCHEMBL12045351 | 0.83 | KDM4E (0.37) | KDM4EMMP2THRBMAPK1HSD17B10 |
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-4330537-A | PHOSPHONATE COMPOUNDS AND VITAMIN D DERIVATIVES USEFUL AGAINST OSTEOPORSIS | THE PROCTER & GAMBLE COMPANY (US) | 1982-05-18 | — | — | US | claimed |