Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | PGR | P06401 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
| ▸ | AR | P10275 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2503341 | 1.00 | HCAR1 (0.40) | HCAR1CA12CA1CA9HKDC1 | |
| SCHEMBL2495828 | 0.81 | HCAR1 (0.35) | HCAR1CA12CA1CA9FOLH1 | |
| SCHEMBL27830838 | 0.81 | HCAR1 (0.35) | HCAR1CA12CA1CA9FOLH1 | |
| SCHEMBL2503184 | 0.81 | HCAR1 (0.35) | HCAR1CA12CA1CA9FOLH1 | |
| SCHEMBL2505243 | 0.76 | PSEN1 (0.44) | LMNA | |
| SCHEMBL2505640 | 0.76 | PSEN1 (0.44) | LMNA | |
| SCHEMBL13731382 | 0.76 | OPRM1 (0.57) | HKDC1OPRM1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL2498460 | 0.76 | OPRM1 (0.57) | HKDC1OPRM1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL2501603 | 0.76 | OPRM1 (0.57) | HKDC1OPRM1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL13731381 | 0.76 | OPRM1 (0.57) | HKDC1OPRM1CYP3A4CYP2C9CYP2C19 |
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-8030354-B2 | 2-(5,5-Dimethylcyclopent-1-enyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane; metabolic disorders such as type II diabetes | AMGEN INC. (US) | 2011-10-04 | — | — | US | disclosed |