Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FDPS | P14324 | 3/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | BTN3A1 | O00481 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | GGPS1 | O95749 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | MMP9 | P14780 | 1/20 | 0.35 |
| ▸ | MMP8 | P22894 | 1/20 | 0.35 |
| ▸ | MMP14 | P50281 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | CYP26A1 | O43174 | 8/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP24A1 | Q07973 | 2/20 | 0.33 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.33 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.32 |
| ▸ | CYP17A1 | P05093 | 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 | |
|---|---|---|---|---|
| SCHEMBL9738425 | 0.75 | KDM4E (0.43) | CYP19A1KDM4ECYP26A1ALDH1A1CYP24A1 | |
| SCHEMBL12002759 | 0.74 | KDM4E (0.42) | CYP19A1KDM4ECYP26A1ALDH1A1TBXAS1 | |
| SCHEMBL9114540 | 0.71 | FDPS (0.61) | FDPSBTN3A1CA12GGPS1CA2 | |
| SCHEMBL240573 | 0.70 | FDPS (0.43) | FDPSCYP19A1BTN3A1CA12GGPS1 | |
| SCHEMBL29035500 | 0.70 | CYP19A1 (0.44) | CYP19A1KDM4ECYP26A1ALDH1A1TBXAS1 | |
| SCHEMBL13225801 | 0.70 | KDM4E (0.43) | KDM4ECYP26A1ALDH1A1CYP24A1TBXAS1 | |
| SCHEMBL8843686 | 0.70 | FDPS (0.59) | FDPSBTN3A1CA12GGPS1CA2 | |
| Water SCHEMBL2111846 | 0.69 | FDPS (0.42) | FDPSCYP19A1BTN3A1CA12GGPS1 | |
| Hydrochloric Acid SCHEMBL28610443 | 0.69 | CYP19A1 (0.42) | CYP19A1KDM4ECYP26A1ALDH1A1TBXAS1 | |
| SCHEMBL7245729 | 0.68 | FDPS (0.44) | FDPSCYP19A1BTN3A1CA12GGPS1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5627170-A | Phosphonic acid compound containing heterocyclic substituents, pharmaceutical composition contains same and a method of treating calcium metabolism disturbance | BOEHRINGER MANNHEIM GMBH (DE) | 1997-05-06 | — | — | US | disclosed |
| US-5538957-A | OSTEOPOROSIS | BOEHRINGER MANNHEIM GMBH (DE) | 1996-07-23 | — | — | US | disclosed |