Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 6/20 | 0.38 |
| ▸ | CA12 | O43570 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | MMP8 | P22894 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.34 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8528407 | 0.87 | PTPN1 (0.41) | KIF11GAAFOLH1PTPN1ALDH1A1 | |
| SCHEMBL8531845 | 0.86 | MEN1 (0.38) | KIF11FOLH1PTPN1 | |
| SCHEMBL8532545 | 0.85 | KIF11 (0.40) | KIF11MMP2FOLH1PTPN1 | |
| SCHEMBL8530829 | 0.85 | ALDH1A1 (0.40) | GAAMAPTALDH1A1NPC1RAB9A | |
| SCHEMBL8531385 | 0.84 | GRM4 (0.39) | KIF11PTPN1MAPTALDH1A1 | |
| SCHEMBL8532183 | 0.83 | MEN1 (0.44) | CA12CA1GAACA9CA14 | |
| SCHEMBL8529305 | 0.83 | PTPN5 (0.47) | MMP8MMP2PTPN1MAPTALDH1A1 | |
| SCHEMBL8531478 | 0.83 | PTPN1 (0.30) | PTPN1 | |
| SCHEMBL8529288 | 0.82 | PTPN5 (0.43) | GAAMMP2PTPN1MAPT | |
| SCHEMBL8583979 | 0.82 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0752999-B1 | 2,4-DIPHOSPHONOGLUTARIC ACID DERIVATIVES, METHODS OF PREPARING SUCH COMPOUNDS AND DRUGS CONTAINING THEM | BOEHRINGER MANNHEIM GMBH (DE) | 1998-10-28 | — | — | EP | disclosed |
| US-5698541-A | DISEASES OF CALCIUM METABOLISM; OSTEOPOROSIS | BOEHRINGER MANNHEIM GMBH (DE) | 1997-12-16 | — | — | US | disclosed |