Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | DRD4 | P21917 | 7/20 | 0.43 |
| ▸ | HTR1A | P08908 | 6/20 | 0.43 |
| ▸ | DRD1 | P21728 | 6/20 | 0.43 |
| ▸ | DRD5 | P21918 | 6/20 | 0.43 |
| ▸ | DRD3 | P35462 | 6/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.43 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.43 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 7/20 | 0.43 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.41 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.41 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7416521 | 0.91 | KMT2A (0.45) | KMT2ACHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL7416518 | 0.91 | KMT2A (0.45) | KMT2ACHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL7416523 | 0.91 | KMT2A (0.45) | KMT2ACHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL5076788 | 0.90 | KDM4E (0.48) | KMT2ADRD4HTR1ADRD1DRD5 | |
| SCHEMBL5083179 | 0.89 | HTT (0.44) | DRD4HTR1ADRD1DRD5DRD3 | |
| SCHEMBL5083196 | 0.89 | HTT (0.44) | DRD4HTR1ADRD1DRD5DRD3 | |
| SCHEMBL5083190 | 0.89 | HTT (0.44) | DRD4HTR1ADRD1DRD5DRD3 | |
| Hydrochloric Acid SCHEMBL1152994 | 0.89 | HTT (0.43) | DRD4HTR1ADRD1DRD5DRD3 | |
| SCHEMBL5141567 | 0.89 | HTR1A (0.44) | KMT2ADRD4HTR1ADRD1DRD5 | |
| Hydrochloric Acid SCHEMBL1152993 | 0.89 | HTT (0.43) | DRD4HTR1ADRD1DRD5DRD3 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008133884-A2 | METHODS AND COMPOSITIONS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS | COMBINATORX, INCORPORATED (US) | 2008-11-06 | — | — | WO | disclosed |
| EP-0266574-B1 | Piperidine compounds and their preparation and use | NOVO NORDISK AS (DK) | 1994-01-05 | — | — | EP | disclosed |
| US-5019582-A | Preventing Calcium Overload In Brain Cells | NOVO NORDISK A/S (DK) | 1991-05-28 | — | — | US | disclosed |
| US-4985446-A | CALCIUM OVERLOAD BLOCKERS IN BRAIN CELLS | A/S FERROSAN (DK) | 1991-01-15 | — | — | US | disclosed |
| US-4877799-A | Method of treating calcium overload in brain cells of mammals | A/S FERROSAN (DK) | 1989-10-31 | — | — | US | disclosed |