Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 6/20 | 0.67 |
| ▸ | LMNA | P02545 | 6/20 | 0.67 |
| ▸ | SERPINA6 | P08185 | 6/20 | 0.67 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.67 |
| ▸ | TSHR | P16473 | 4/20 | 0.67 |
| ▸ | MAPT | P10636 | 4/20 | 0.67 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.67 |
| ▸ | GPBAR1 | Q8TDU6 | 4/20 | 0.67 |
| ▸ | SHBG | P04278 | 4/20 | 0.67 |
| ▸ | NR3C1 | P04150 | 3/20 | 0.67 |
| ▸ | PGR | P06401 | 3/20 | 0.67 |
| ▸ | AR | P10275 | 3/20 | 0.67 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.67 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.67 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.67 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.67 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.67 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.67 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.67 |
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 | |
|---|---|---|---|---|
| SCHEMBL3661927 | 1.00 | CYP3A4 (0.67) | CYP3A4LMNASERPINA6SMN1; SMN2TSHR | |
| SCHEMBL5436459 | 1.00 | CYP3A4 (0.67) | CYP3A4LMNASERPINA6SMN1; SMN2TSHR | |
| SCHEMBL8069 | 1.00 | CYP3A4 (0.67) | CYP3A4LMNASERPINA6SMN1; SMN2TSHR | |
| SCHEMBL1457788 | 1.00 | CYP3A4 (0.67) | CYP3A4LMNASERPINA6SMN1; SMN2TSHR | |
| SCHEMBL571703 | 1.00 | CYP3A4 (0.67) | CYP3A4LMNASERPINA6SMN1; SMN2TSHR | |
| SCHEMBL25333984 | 1.00 | CYP3A4 (0.67) | CYP3A4LMNASERPINA6SMN1; SMN2TSHR | |
| SCHEMBL4747200 | 1.00 | CYP3A4 (0.67) | CYP3A4LMNASERPINA6SMN1; SMN2TSHR | |
| SCHEMBL2724646 | 1.00 | CYP3A4 (0.67) | CYP3A4LMNASERPINA6SMN1; SMN2TSHR | |
| Hydrochloric Acid SCHEMBL3198033 | 0.99 | CYP3A4 (0.66) | CYP3A4LMNASERPINA6SMN1; SMN2TSHR | |
| Bicarbonate SCHEMBL6684636 | 0.98 | CYP3A4 (0.65) | CYP3A4LMNASERPINA6SMN1; SMN2TSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8809001-B2 | High throughput assays for inhibitors and activators of PAQR receptors | UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) | 2014-08-19 | — | — | US | disclosed |
| US-20100261178-A1 | High Throughput Assays for Inhibitors and Activators of PAQR Receptors | UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) | 2010-10-14 | — | — | US | disclosed |