Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNA3 | P22001 | 1/20 | 0.52 |
| ▸ | FDPS | P14324 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | DRD2 | P14416 | 2/20 | 0.47 |
| ▸ | DRD4 | P21917 | 2/20 | 0.47 |
| ▸ | DRD3 | P35462 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | MMP2 | P08253 | 1/20 | 0.46 |
| ▸ | MMP8 | P22894 | 1/20 | 0.46 |
| ▸ | MMP14 | P50281 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | HTR1B | P28222 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8960602 | 0.98 | KCNA3 (0.50) | KCNA3FDPSHPGDL3MBTL1NPC1 | |
| SCHEMBL8960557 | 0.97 | KCNA3 (0.48) | KCNA3FDPSHPGDL3MBTL1NPC1 | |
| SCHEMBL8960357 | 0.97 | KCNA3 (0.48) | KCNA3FDPSHPGDL3MBTL1NPC1 | |
| Water SCHEMBL8915961 | 0.97 | KCNA3 (0.48) | KCNA3FDPSHPGDL3MBTL1NPC1 | |
| SCHEMBL8803229 | 0.95 | FDPS (0.55) | KCNA3FDPSHPGDL3MBTL1NPC1 | |
| SCHEMBL8960624 | 0.94 | FDPS (0.54) | KCNA3FDPSHPGDL3MBTL1NPC1 | |
| SCHEMBL7026889 | 0.92 | FDPS (0.44) | KCNA3FDPSHPGDL3MBTL1NPC1 | |
| SCHEMBL8960346 | 0.90 | FDPS (0.43) | KCNA3FDPSHPGDL3MBTL1NPC1 | |
| Water SCHEMBL8915957 | 0.90 | FDPS (0.43) | KCNA3FDPSHPGDL3MBTL1NPC1 | |
| SCHEMBL8960536 | 0.90 | FDPS (0.43) | KCNA3FDPSHPGDL3MBTL1NPC1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0491374-B1 | Bisphosphonic acid derivatives, their production and use | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1996-01-31 | — | — | EP | claimed |
| US-5280022-A | Containing an amine group | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1994-01-18 | — | — | US | claimed |
| EP-0491374-A1 | Bisphosphonic acid derivatives, their production and use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1992-06-24 | — | — | EP | claimed |
| EP-0491374-B1 | Bisphosphonic acid derivatives, their production and use | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1996-01-31 | — | — | EP | disclosed |
| US-5280022-A | Containing an amine group | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1994-01-18 | — | — | US | disclosed |
| EP-0491374-A1 | Bisphosphonic acid derivatives, their production and use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1992-06-24 | — | — | EP | disclosed |