Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR2 | O43614 | 1/20 | 0.37 |
| ▸ | KDM1A | O60341 | 4/20 | 0.36 |
| ▸ | MOGAT2 | Q3SYC2 | 2/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 4/20 | 0.34 |
| ▸ | ADRB1 | P08588 | 4/20 | 0.34 |
| ▸ | ADRB3 | P13945 | 4/20 | 0.34 |
| ▸ | SLC18A3 | Q16572 | 2/20 | 0.34 |
| ▸ | PRCP | P42785 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8489440 | 0.89 | HCRTR2 (0.37) | HCRTR2MOGAT2ADRB2ADRB1ADRB3 | |
| SCHEMBL9004363 | 0.74 | PER2 (0.52) | — | |
| SCHEMBL8491337 | 0.67 | TSHR (0.39) | ADRB2ADRB1ADRB3CA1CA2 | |
| SCHEMBL27648542 | 0.63 | MEN1 (0.50) | SLC18A3 | |
| SCHEMBL23816922 | 0.62 | SLC18A3 (0.60) | SLC18A3 | |
| SCHEMBL8489489 | 0.62 | CRY1 (0.60) | — | |
| SCHEMBL7202138 | 0.61 | SLC18A3 (0.62) | SLC18A3 | |
| SCHEMBL13377720 | 0.61 | MEN1 (0.36) | HCRTR2MOGAT2 | |
| SCHEMBL13377724 | 0.59 | TSHR (0.46) | — | |
| SCHEMBL13381275 | 0.59 | MEN1 (0.48) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5919431-A | 1,4,7,10-tetraazacyclododecane derivatives, their use, pharmaceutical agents containing these compounds and process for their production | SCHERING AKTIENGESELLSCHAFT (DE) | 1999-07-06 | — | — | US | disclosed |