Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM3 | P20309 | 7/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 4/20 | 0.47 |
| ▸ | CHRM4 | P08173 | 4/20 | 0.47 |
| ▸ | CHRM5 | P08912 | 4/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.47 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5724616 | 1.00 | CHRM3 (0.47) | CHRM3CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL7979790 | 0.79 | CHRM3 (0.45) | CHRM3CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL5724839 | 0.79 | CHRM3 (0.45) | CHRM3CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL5725074 | 0.79 | CHRM3 (0.45) | CHRM3CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL7979788 | 0.79 | CHRM3 (0.45) | CHRM3CHRM2CHRM4CHRM5CHRM1 | |
| Bromide SCHEMBL7977250 | 0.78 | CHRM3 (0.44) | CHRM3CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL7976983 | 0.71 | KDM4E (0.45) | CHRM3CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL5725521 | 0.70 | HTR2C (0.68) | CHRM3CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL5725258 | 0.70 | — | — | |
| SCHEMBL8348647 | 0.70 | GAA (0.38) | CHRM3CHRM2CHRM4CHRM5CHRM1 |
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-0812318-B1 | 4-AMINOTETRAHYDROBENZISOXAZOLE OR -ISOTHIAZOLE COMPOUNDS | LUNDBECK & CO AS H (DK) | 2006-02-08 | — | — | EP | disclosed |
| US-6174909-B1 | FOR TREATING ANALGESIA, PSYCHOSIS, CONVULSIONS, EPILEPSY, ANXIETY, MUSCULAR AND MOVEMENT DISORDERS, SPASTIC DISORDERS OR SYMPTOMS OF HUNTINGTON'S OR PARKINSONS DISEASE | H. LUNDBECK A/S (DK) | 2001-01-16 | — | — | US | disclosed |
| US-5998613-A | PSYCHOLOGICAL DISORDERS; ANALGESICS; ANTICONVULSANTS | H. LUNDBECK A/S (DK) | 1999-12-07 | — | — | US | disclosed |