Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.65 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.51 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.51 |
| ▸ | CA12 | O43570 | 1/20 | 0.51 |
| ▸ | CA1 | P00915 | 1/20 | 0.51 |
| ▸ | CA2 | P00918 | 1/20 | 0.51 |
| ▸ | CA9 | Q16790 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL2224069 | 0.81 | CA12 (0.73) | GAASMN1; SMN2MTNR1AMTNR1BCA12 | |
| Water SCHEMBL11279885 | 0.80 | CA12 (0.71) | GAASMN1; SMN2MTNR1AMTNR1BCA12 | |
| SCHEMBL11576174 | 0.79 | GAA (1.00) | GAANPSR1SMN1; SMN2LMNAHTT | |
| SCHEMBL11575374 | 0.79 | GAA (0.74) | GAANPSR1SMN1; SMN2LMNAHTT | |
| SCHEMBL8725247 | 0.78 | ALDH1A1 (0.58) | SMN1; SMN2MTNR1AMTNR1BCYP1A2CYP3A4 | |
| SCHEMBL31467898 | 0.76 | MEN1 (0.52) | SMN1; SMN2MTNR1AMTNR1B | |
| SCHEMBL19468576 | 0.75 | SMN1; SMN2 (0.67) | SMN1; SMN2MAPK1CYP3A4 | |
| SCHEMBL11812190 | 0.74 | LMNA (0.68) | GAANPSR1SMN1; SMN2LMNAHTT | |
| SCHEMBL2224185 | 0.74 | SMN1; SMN2 (0.48) | SMN1; SMN2MTNR1AMTNR1BCYP3A4 | |
| SCHEMBL31467946 | 0.74 | SMN1; SMN2 (0.45) | SMN1; SMN2MTNR1AMTNR1BCYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0624584-B1 | Piperazine derivatives useful as calmodulin inhibitors | DAIICHI SEIYAKU CO (JP) | 1998-08-19 | — | — | EP | disclosed |
| US-5681954-A | HAS CALMODULIN INHIBITORY ACTIVITY; USEFUL IN TREATING DISEASES OF THE CIRCULATORY ORGANS OR IN CEREBRAL REGION | DAIICHI PHARMACEUTICAL CO., LTD. (JP) | 1997-10-28 | — | — | US | disclosed |
| EP-0624584-A1 | Piperazine derivatives useful as calmodolin inhibitors | DAIICHI PHARMACEUTICAL CO., LTD. (JP) | 1994-11-17 | — | — | EP | disclosed |