Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 3/20 | 0.56 |
| ▸ | PPARG | P37231 | 2/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.53 |
| ▸ | CNR1 | P21554 | 1/20 | 0.53 |
| ▸ | CNR2 | P34972 | 1/20 | 0.53 |
| ▸ | GGPS1 | O95749 | 2/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.52 |
| ▸ | DHFR | P00374 | 5/20 | 0.49 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL8778537 | 0.95 | PPARA (0.58) | PPARAPPARGTSHRCYP2D6CNR1 | |
| SCHEMBL9255242 | 0.95 | CYP2D6 (0.55) | PPARAPPARGTSHRCYP2D6CNR1 | |
| SCHEMBL9579218 | 0.94 | PPARA (0.60) | PPARAPPARGTSHRCYP2D6CNR1 | |
| SCHEMBL3031825 | 0.94 | PPARA (0.60) | PPARAPPARGTSHRCYP2D6CNR1 | |
| SCHEMBL3021697 | 0.94 | PPARA (0.60) | PPARAPPARGTSHRCYP2D6CNR1 | |
| SCHEMBL7854103 | 0.94 | PPARA (0.60) | PPARAPPARGTSHRCYP2D6CNR1 | |
| SCHEMBL8927722 | 0.92 | PPARA (0.62) | PPARAPPARGTSHRCYP2D6CNR1 | |
| SCHEMBL9172207 | 0.92 | PPARA (0.50) | PPARAPPARGTSHRCYP2D6CNR1 | |
| SCHEMBL4568871 | 0.90 | PPARA (0.61) | PPARAPPARGTSHRCYP2D6CNR1 | |
| SCHEMBL3035008 | 0.89 | PPARA (0.58) | PPARAPPARGTSHRCYP2D6CNR1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5652247-A | VASOPRESSIN ANTAGONIST | OTSUKA PHARMACEUTICAL CO., LTD (JP) | 1997-07-29 | — | — | US | disclosed |
| US-5436254-A | Vaopressin antagonists | OTSUKA PHARMACEUTICAL COMPANY, LTD. (JP) | 1995-07-25 | — | — | US | disclosed |
| EP-0602209-A1 | OXYTOCIN ANTAGONIST | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1994-06-22 | — | — | EP | disclosed |
| EP-0382185-B1 | Carbostyril derivatives | OTSUKA PHARMA CO LTD (JP) | 1994-06-15 | — | — | EP | disclosed |
| WO-1994001113-A1 | OXYTOCIN ANTAGONIST | OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) | 1994-01-20 | — | — | WO | disclosed |
| US-5225402-A | Vasopressin antagonist, vasodilation, hypotensive, diuretics and anticoagulants | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1993-07-06 | — | — | US | disclosed |
| CN-1046529-A | Carbostyril derivative | OTSUKA PHARMA CO LTD (JP) | 1990-10-31 | — | — | CN | disclosed |