Known targets — ChEMBL curated mechanism
GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQ
The experimentally established mechanism targets of Pentobarbital. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRB3 known ✓ | P28472 | 1/20 | 0.55 |
| ▸ | GABRA2 known ✓ | P47869 | 1/20 | 0.55 |
| ▸ | GABRB2 known ✓ | P47870 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 3/20 | 0.53 |
| ▸ | MMP9 | P14780 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Pentobarbital SCHEMBL7033991 | 0.98 | CYP3A4 (0.57) | CYP3A4KDM4EALDH1A1GABRB3OPRD1 | |
| Pentobarbital SCHEMBL9221628 | 0.98 | CYP3A4 (0.57) | CYP3A4KDM4EALDH1A1GABRB3OPRD1 | |
| Pentobarbital SCHEMBL1247 | 0.98 | CYP3A4 (0.57) | CYP3A4KDM4EALDH1A1GABRB3OPRD1 | |
| Pentobarbital SCHEMBL2475274 | 0.97 | CYP3A4 (0.55) | CYP3A4KDM4EALDH1A1GABRB3OPRD1 | |
| Pentobarbital SCHEMBL21634384 | 0.97 | CYP3A4 (0.55) | CYP3A4KDM4EALDH1A1GABRB3OPRD1 | |
| Pentobarbital SCHEMBL11127769 | 0.97 | CYP3A4 (0.55) | CYP3A4KDM4EALDH1A1GABRB3OPRD1 | |
| Pentobarbital SCHEMBL11559632 | 0.97 | CYP3A4 (0.55) | CYP3A4KDM4EALDH1A1GABRB3OPRD1 | |
| Pentobarbital SCHEMBL9216527 | 0.97 | CYP3A4 (0.55) | CYP3A4KDM4EALDH1A1GABRB3OPRD1 | |
| Pentobarbital SCHEMBL6594849 | 0.97 | CYP3A4 (0.55) | CYP3A4KDM4EALDH1A1GABRB3OPRD1 | |
| Pentobarbital SCHEMBL1052470 | 0.97 | CYP3A4 (0.55) | CYP3A4KDM4EALDH1A1GABRB3OPRD1 |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024090867-A1 | POLYETHYLENE RESIN HAVING EXCELLENT THERMAL RESISTANCE | 주식회사 엘지화학 | 2024-05-02 | — | — | WO | disclosed |
| WO-2024090868-A1 | POLYETHYLENE RESIN HAVING EXCELLENT HEAT RESISTANCE | 주식회사 엘지화학 | 2024-05-02 | — | — | WO | disclosed |
| WO-2023172009-A1 | ETHYLENE/1-HEXENE COPOLYMER HAVING IMPROVED LONG-TERM PHYSICAL PROPERTY STABILITY AND PROCESSABILITY | 주식회사 엘지화학 | 2023-09-14 | — | — | WO | disclosed |
| WO-2023075115-A1 | POLYETHYLENE RESIN COMPOSITION AND FILM COMPRISING SAME | 주식회사 엘지화학 | 2023-05-04 | — | — | WO | disclosed |
| WO-2022071744-A1 | ETHYLENE/1-HEXENE COPOLYMER HAVING EXCELLENT CONSTRUCTABILITY AND PROCESSABILITY | 주식회사 엘지화학 | 2022-04-07 | — | — | WO | disclosed |
| WO-2021112623-A1 | POLYPROPYLENE RESIN, POLYPROPYLENE FIBER AND METHOD FOR PREPARING SAME | 주식회사 엘지화학 | 2021-06-10 | — | — | WO | disclosed |
| WO-2021083309-A1 | METALLOCENE COMPOUND, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | 中国石油化工股份有限公司 | 2021-05-06 | — | — | WO | disclosed |
| WO-2021071154-A1 | POLYETHYLENE AND PREPARATION METHOD THEREFOR | 주식회사 엘지화학 | 2021-04-15 | — | — | WO | disclosed |
| WO-2021066437-A1 | ETHYLENE/1-HEXENE COPOLYMER HAVING EXCELLENT LONG-TERM PROPERTIES AND PROCESSIBILITY | 주식회사 엘지화학 | 2021-04-08 | — | — | WO | disclosed |
| WO-2021066398-A1 | PELLET-TYPE POLYPROPYLENE RESIN COMPOSITION AND PREPARATION METHOD THEREFOR | 주식회사 엘지화학 | 2021-04-08 | — | — | WO | disclosed |
| WO-2021060907-A1 | POLYETHYLENE, AND CHLORINATED POLYETHYLENE THEREOF | 주식회사 엘지화학 | 2021-04-01 | — | — | WO | disclosed |
| WO-2021060908-A1 | SUPPORTED HYBRID CATALYST AND METHOD FOR PREPARING POLYOLEFIN BY USING SAME | 주식회사 엘지화학 | 2021-04-01 | — | — | WO | disclosed |
| WO-2021040425-A1 | POLYPROPYLENE-BASED COMPOSITE AND METHOD FOR PRODUCING SAME | 주식회사 엘지화학 | 2021-03-04 | — | — | WO | disclosed |
| WO-2021040139-A1 | OLEFINIC COPOLYMER AND PREPARATION METHOD THEREFOR | 주식회사 엘지화학 | 2021-03-04 | — | — | WO | disclosed |