Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 8/20 | 0.61 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.56 |
| ▸ | THRA | P10827 | 1/20 | 0.53 |
| ▸ | THRB | P10828 | 1/20 | 0.53 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.50 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.50 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.49 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.49 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.49 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 0.49 |
| ▸ | LTA4H | P09960 | 1/20 | 0.49 |
| ▸ | CNR1 | P21554 | 2/20 | 0.48 |
| ▸ | CNR2 | P34972 | 1/20 | 0.48 |
| ▸ | CHUK | O15111 | 1/20 | 0.46 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.46 |
| ▸ | JAK2 | O60674 | 1/20 | 0.46 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.46 |
| ▸ | PRKCG | P05129 | 1/20 | 0.46 |
| ▸ | CDK1 | P06493 | 1/20 | 0.46 |
| ▸ | PIM1 | P11309 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9697402 | 1.00 | ESR1 (0.61) | ESR1NR5A1THRATHRBCYSLTR2 | |
| SCHEMBL9699080 | 1.00 | ESR1 (0.61) | ESR1NR5A1THRATHRBCYSLTR2 | |
| SCHEMBL11796987 | 1.00 | ESR1 (0.61) | ESR1NR5A1THRATHRBCYSLTR2 | |
| SCHEMBL11071449 | 0.98 | ESR1 (0.58) | ESR1NR5A1THRATHRBCYSLTR2 | |
| SCHEMBL8864262 | 0.93 | ESR1 (0.59) | ESR1NR5A1THRATHRBCYSLTR2 | |
| SCHEMBL3291614 | 0.92 | ESR1 (0.54) | ESR1NR5A1THRATHRBCYSLTR2 | |
| SCHEMBL14747883 | 0.87 | ESR1 (0.49) | ESR1THRATHRBLTA4HMEN1 | |
| SCHEMBL17445869 | 0.86 | NR5A1 (0.56) | ESR1NR5A1CYSLTR2CYSLTR1LTA4H | |
| SCHEMBL9699699 | 0.86 | NR5A1 (0.56) | ESR1NR5A1CYSLTR2CYSLTR1LTA4H | |
| SCHEMBL28095186 | 0.84 | NR5A1 (0.58) | ESR1NR5A1CYSLTR2CYSLTR1S1PR2 |
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-5147864-A | Bronchodilator agent, antianaphylactic agent, antishock agent, cardiotonic agent and anticarcinogenic agent | AMERICAN CYANAMID COMPANY (US) | 1992-09-15 | — | — | US | disclosed |
| US-4983592-A | Bis-arylphosphate ester antagonists of platelet activating factor | AMERICAN CYANAMID CO. (US) | 1991-01-08 | — | — | US | disclosed |