Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.34 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.32 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.32 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | BBOX1 | O75936 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL277802 | 0.95 | CYP1A2 (0.40) | CYP1A2GPR84FFAR1FFAR4PTGS1 | |
| Ethylene Glycol SCHEMBL4613517 | 0.91 | CAMK2A (0.36) | CYP1A2CAMK2AGPR84FFAR1FFAR4 | |
| SCHEMBL15106900 | 0.85 | CYP1A2 (0.35) | CYP1A2GPR84FFAR1FFAR4 | |
| SCHEMBL3764030 | 0.85 | CYP1A2 (0.44) | CYP1A2PTGS1BBOX1 | |
| SCHEMBL2159793 | 0.82 | LMNA (0.37) | CYP1A2GPR84FFAR1FFAR4 | |
| SCHEMBL4539487 | 0.81 | CYP1A2 (0.46) | CYP1A2GPR84FFAR1FFAR4PTGS1 | |
| Ethylene Glycol SCHEMBL6051015 | 0.78 | CAMK2A (0.52) | CYP1A2CAMK2AGPR84FFAR1FFAR4 | |
| Ethylene Glycol SCHEMBL4414824 | 0.78 | CAMK2A (0.37) | CAMK2AGPR84FFAR1FFAR4 | |
| SCHEMBL22098195 | 0.77 | CYP4F2 (0.38) | CYP1A2 | |
| Ethylene Glycol SCHEMBL250392 | 0.75 | CYP2C19 (0.48) | CYP1A2CAMK2AGPR84FFAR1FFAR4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20030225240-A1 | Modified urethane compositions containing adducts of O-phthalic anhydride ester polyols | UNIROYAL CHEMICAL COMPANY, INC. | 2003-12-04 | — | — | US | disclosed |
| WO-2002004536-A2 | MODIFIED URETHANE COMPOSITIONS CONTAINING ADDUCTS OF O-PHTHALIC ANHYDRIDE ESTER POLYOLS | UNIROYAL CHEMICAL COMPANY, INC. (US) | 2002-01-17 | — | — | WO | disclosed |
| EP-0171085-A2 | Vulcanized rubber article and the process for production thereof | KURARAY CO., LTD. (JP) | 1986-02-12 | — | — | EP | disclosed |