Known targets — ChEMBL curated mechanism
MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Diethyl Pyrocarbonate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SOAT1 | P35610 | 1/20 | 0.88 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.67 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | MGAM | O43451 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | SI | P14410 | 1/20 | 0.46 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.46 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.35 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Diethyl Pyrocarbonate SCHEMBL15582 | 0.94 | SOAT1 (1.00) | SOAT1ALDH1A1LMNAHSD17B10ALOX15 | |
| Diethyl Pyrocarbonate SCHEMBL30366210 | 0.94 | SOAT1 (1.00) | SOAT1ALDH1A1LMNAHSD17B10ALOX15 | |
| Diethyl Pyrocarbonate SCHEMBL3815029 | 0.91 | SOAT1 (0.94) | SOAT1ALDH1A1LMNAHSD17B10ALOX15 | |
| SCHEMBL28247811 | 0.91 | SOAT1 (0.94) | SOAT1ALDH1A1LMNAHSD17B10ALOX15 | |
| Diethyl Pyrocarbonate SCHEMBL28670714 | 0.91 | SOAT1 (0.94) | SOAT1ALDH1A1LMNAHSD17B10ALOX15 | |
| SCHEMBL27594089 | 0.89 | SOAT1 (0.79) | SOAT1ALDH1A1LMNAHSD17B10ALOX15 | |
| Alcohol SCHEMBL4867703 | 0.88 | ALDH1A1 (0.87) | SOAT1ALDH1A1LMNAHSD17B10ALOX15 | |
| Alcohol SCHEMBL27831880 | 0.85 | ALDH1A1 (0.81) | SOAT1ALDH1A1LMNAHSD17B10ALOX15 | |
| Diethyl Pyrocarbonate SCHEMBL2949382 | 0.85 | SOAT1 (0.71) | SOAT1ALDH1A1LMNAHSD17B10ALOX15 | |
| Diethyl Pyrocarbonate SCHEMBL8342707 | 0.83 | SOAT1 (0.79) | SOAT1ALDH1A1LMNAHSD17B10ALOX15 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105087459-A | In-vitro small intestine stem cell culture medium and culture method | FAR EASTERN MEMORIAL HOSPITAL | 2015-11-25 | — | — | CN | disclosed |