Known targets — ChEMBL curated mechanism
GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQ
The experimentally established mechanism targets of Chlordiazepoxide. 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 | |
|---|---|---|---|---|
| ▸ | GABRP known ✓ | O00591 | 1/20 | 0.31 |
| ▸ | GABRD known ✓ | O14764 | 1/20 | 0.31 |
| ▸ | GABRA1 known ✓ | P14867 | 1/20 | 0.31 |
| ▸ | GABRB1 known ✓ | P18505 | 1/20 | 0.31 |
| ▸ | GABRG2 known ✓ | P18507 | 1/20 | 0.31 |
| ▸ | GABRB3 known ✓ | P28472 | 1/20 | 0.31 |
| ▸ | GABRA5 known ✓ | P31644 | 1/20 | 0.31 |
| ▸ | GABRA3 known ✓ | P34903 | 1/20 | 0.31 |
| ▸ | GABRA2 known ✓ | P47869 | 1/20 | 0.31 |
| ▸ | GABRB2 known ✓ | P47870 | 1/20 | 0.31 |
| ▸ | GABRA4 known ✓ | P48169 | 1/20 | 0.31 |
| ▸ | GABRE known ✓ | P78334 | 1/20 | 0.31 |
| ▸ | GABRA6 known ✓ | Q16445 | 1/20 | 0.31 |
| ▸ | GABRG1 known ✓ | Q8N1C3 | 1/20 | 0.31 |
| ▸ | GABRG3 known ✓ | Q99928 | 1/20 | 0.31 |
| ▸ | GABRQ known ✓ | Q9UN88 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Chlordiazepoxide SCHEMBL29358041 | 0.98 | CYP1A2 (0.60) | CYP1A2KDM4ERXFP1TP53MAPT | |
| Chlordiazepoxide SCHEMBL10887473 | 0.98 | CYP1A2 (0.60) | CYP1A2KDM4ERXFP1TP53MAPT | |
| Chlordiazepoxide SCHEMBL5974493 | 0.96 | CYP1A2 (0.59) | CYP1A2KDM4ERXFP1TP53MAPT | |
| Chlordiazepoxide SCHEMBL27542874 | 0.96 | CYP1A2 (0.59) | CYP1A2KDM4ERXFP1TP53MAPT | |
| Chlordiazepoxide SCHEMBL27742440 | 0.96 | CYP1A2 (0.59) | CYP1A2KDM4ERXFP1TP53MAPT | |
| Chlordiazepoxide SCHEMBL5446390 | 0.96 | CYP1A2 (0.59) | CYP1A2KDM4ERXFP1TP53MAPT | |
| Chlordiazepoxide SCHEMBL19181183 | 0.96 | CYP1A2 (0.59) | CYP1A2KDM4ERXFP1TP53MAPT | |
| Chlordiazepoxide SCHEMBL8935 | 0.96 | CYP1A2 (0.59) | CYP1A2KDM4ERXFP1TP53MAPT | |
| Chlordiazepoxide SCHEMBL9069069 | 0.96 | CYP1A2 (0.59) | CYP1A2KDM4ERXFP1TP53MAPT | |
| Chlordiazepoxide SCHEMBL3179106 | 0.95 | CYP1A2 (0.64) | CYP1A2KDM4ERXFP1TP53MAPT |
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 |
|---|---|---|---|---|---|---|---|
| JP-60013748-A | — | — | None | — | — | JP | disclosed |
| US-5814693-A | MONOLITHIC, CHEMICAL RESISTANT CONTAINMENT COATING ON CONCRETES WITH CHLOROSULFONATED POLYETHYLENE, 3-AMINOPROPYL TRIETHOXYSILANE, DIBUTYLTIN DILAURATE PROMOTERS AND EPOXY RESIN SCAVENGERS | FORTY TEN, L.L.C. (US) | 1998-09-29 | — | — | US | disclosed |
| JP-S6013748-A | PRODUCTION OF HYDRAZINE-CARBONYL COMPOUND | MITSUBISHI GAS CHEM CO INC | 1985-01-24 | — | — | JP | disclosed |
| US-4089886-A | Methanol purification | CELANESE CORPORATION (US) | 1978-05-16 | — | — | US | disclosed |