Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | RGS12 | O14924 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | APEX1 | P27695 | 1/20 | 0.44 |
| ▸ | THPO | P40225 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.44 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Ethylene Glycol SCHEMBL6229361 | 1.00 | AKR1B1 (0.52) | AKR1B1CYP1A2CYP2C19LMNAGAA | |
| SCHEMBL40418 | 0.94 | AKR1B1 (0.58) | AKR1B1CYP1A2CYP2C19LMNAGAA | |
| 1,3-Propanediol SCHEMBL6335045 | 0.93 | AKR1B1 (0.48) | AKR1B1CYP1A2CYP2C19LMNAGAA | |
| SCHEMBL5341838 | 0.88 | AKR1B1 (0.47) | AKR1B1CYP1A2CYP2C19LMNAGAA | |
| SCHEMBL70565 | 0.80 | AKR1B1 (0.71) | AKR1B1CYP1A2CYP2C19LMNAGAA | |
| Phenylacetic Acid SCHEMBL27486045 | 0.78 | AKR1B1 (0.85) | AKR1B1LMNAGAATSHRPOLB | |
| Hydrochloric Acid SCHEMBL8922940 | 0.78 | AKR1B1 (0.68) | AKR1B1CYP1A2CYP2C19LMNAGAA | |
| SCHEMBL5968748 | 0.77 | AKR1B1 (0.56) | AKR1B1CYP1A2CYP2C19LMNAGAA | |
| SCHEMBL14704483 | 0.77 | AKR1B1 (0.56) | AKR1B1CYP1A2CYP2C19LMNAGAA | |
| SCHEMBL8986802 | 0.77 | ALDH1A1 (0.39) | AKR1B1CYP1A2CYP2C19POLBALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6927247-B2 | Organic thiol metal-free stabilizers and plasticizers for halogen-containing polymers | THE COLLEGE OF WILLIAM AND MARY (US) | 2005-08-09 | — | — | US | claimed |
| EP-1521803-A2 | ORGANIC THIOL METAL-FREE STABILIZERS AND PLASTICIZERS FOR HALOGEN-CONTAINING POLYMERS | The College of William and Mary (US) | 2005-04-13 | — | — | EP | claimed |
| WO-2003106550-A2 | ORGANIC THIOL METAL-FREE STABILIZERS AND PLASTICIZERS FOR HALOGEN-CONTAINING POLYMERS | THE COLLEGE OF WILLIAM AND MARY (US) | 2003-12-24 | — | — | WO | claimed |
| US-20030220429-A1 | Organic thiol metal-free stabilizers and plasticizers for halogen-containing polymers | COLLEGE OF WILLIAM AND MARY, THE | 2003-11-27 | — | — | US | claimed |