Diazepam

Diazepam

SCHEMBL10351230

CN1C(=O)CN=C(c2ccccc2)c2cc(Cl)ccc21.O=C1CN=C(c2ccccn2)c2cc(Br)ccc2N1.O=C1Nc2ccc(Cl)cc2C(c2ccccc2)=NC1O

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQ

The experimentally established mechanism targets of Diazepam. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 known ✓ P14867 4/20 0.51
GABRA5 known ✓ P31644 4/20 0.51
GABRA3 known ✓ P34903 4/20 0.51
GABRA2 known ✓ P47869 4/20 0.51
GABRB2 known ✓ P47870 4/20 0.51
GABRG2 known ✓ P18507 2/20 0.51
GABRB3 known ✓ P28472 2/20 0.51
GABRP known ✓ O00591 1/20 0.51
GABRD known ✓ O14764 1/20 0.51
GABRB1 known ✓ P18505 1/20 0.51
GABRA4 known ✓ P48169 1/20 0.51
GABRE known ✓ P78334 1/20 0.51
GABRA6 known ✓ Q16445 1/20 0.51
GABRG1 known ✓ Q8N1C3 1/20 0.51
GABRG3 known ✓ Q99928 1/20 0.51
GABRQ known ✓ Q9UN88 1/20 0.51
ADRA1A P35348 1/20 0.54
LMNA P02545 4/20 0.51
OPRK1 P41145 3/20 0.51
ALB P02768 2/20 0.51

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.

Compoundsimilaritytop predictedshared targets
Lorazepam SCHEMBL4978513 0.95 ADRA1A (0.51) ADRA1AGABRA1GABRA5GABRA3GABRA2
Diazepam SCHEMBL8329713 0.92 ADRA1A (0.64) ADRA1AGABRA1GABRA5GABRA3GABRA2
Diazepam SCHEMBL10948878 0.86 GABRA1 (0.69) GABRA1GABRA5GABRA3GABRA2GABRB2
Lorazepam SCHEMBL4976540 0.81 LMNA (0.65) GABRA1GABRA5GABRA3GABRA2GABRB2
Diazepam SCHEMBL6823824 0.81 GABRA1 (0.79) GABRA1GABRA5GABRA3GABRA2GABRB2
Diazepam SCHEMBL8931438 0.81 GABRA1 (0.79) GABRA1GABRA5GABRA3GABRA2GABRB2
Oxazepam SCHEMBL6680438 0.80 LMNA (0.81) GABRA1GABRA5GABRA3GABRA2GABRB2
Alprazolam SCHEMBL3664716 0.79 GABRA1 (0.66) ADRA1AGABRA1GABRA5GABRA3GABRA2
Clobazam SCHEMBL28086348 0.79 ADRA1A (0.61) ADRA1AGABRA1GABRA5GABRA3GABRA2
Temazepam SCHEMBL7036032 0.76 OPRK1 (0.82) GABRA1GABRA5GABRA3GABRA2GABRB2

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0167825-A2 Lipid nano pellets as drug carriers for oral administration Dr. Rentschler Arzneimittel GmbH & Co. (DE) 1986-01-15 EP claimed
EP-0167825-B1 LIPID NANO PELLETS AS DRUG CARRIERS FOR ORAL ADMINISTRATION Dr. Rentschler Arzneimittel GmbH & Co. (DE) 1990-08-08 EP disclosed
EP-0167825-A2 Lipid nano pellets as drug carriers for oral administration Dr. Rentschler Arzneimittel GmbH & Co. (DE) 1986-01-15 EP disclosed