Clonazepam

Clonazepam

SCHEMBL16719271

CN1C(=O)C(O)N=C(c2ccccc2)c2cc(Cl)ccc21.O=C1CN=C(c2ccccc2Cl)c2cc([N+](=O)[O-])ccc2N1

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQ

The experimentally established mechanism targets of Clonazepam. 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 7/20 0.61
GABRA5 known ✓ P31644 7/20 0.61
GABRA3 known ✓ P34903 7/20 0.61
GABRG2 known ✓ P18507 6/20 0.61
GABRB3 known ✓ P28472 6/20 0.61
GABRA2 known ✓ P47869 6/20 0.61
GABRB2 known ✓ P47870 6/20 0.61
GABRP known ✓ O00591 4/20 0.61
GABRD known ✓ O14764 4/20 0.61
GABRB1 known ✓ P18505 4/20 0.61
GABRA4 known ✓ P48169 4/20 0.61
GABRE known ✓ P78334 4/20 0.61
GABRA6 known ✓ Q16445 4/20 0.61
GABRG1 known ✓ Q8N1C3 4/20 0.61
GABRG3 known ✓ Q99928 4/20 0.61
GABRQ known ✓ Q9UN88 4/20 0.61
ADRA1A P35348 1/20 0.61
LMNA P02545 6/20 0.57
OPRK1 P41145 5/20 0.57
PDE3A Q14432 1/20 0.57

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
Clonazepam SCHEMBL17728660 0.88 GABRA1 (0.67) GABRA1GABRA5GABRA3GABRG2GABRB3
Clonazepam SCHEMBL5500649 0.85 GABRA1 (0.74) GABRA1GABRA5GABRA3GABRG2GABRB3
Flunitrazepam SCHEMBL8364961 0.84 GABRA1 (0.64) GABRA1GABRA5GABRA3GABRG2GABRB3
Nitrazepam SCHEMBL1956552 0.84 LMNA (0.70) GABRA1GABRA5GABRA3GABRG2GABRB3
Meclonazepam SCHEMBL1003386 0.83 OPRK1 (0.63) GABRA1GABRA5GABRA3GABRG2GABRB3
Flunitrazepam SCHEMBL18316507 0.82 GABRA1 (0.63) GABRA1GABRA5GABRA3GABRG2GABRB3
Flurazepam SCHEMBL10351229 0.81 OPRK1 (0.57) GABRA1GABRA5GABRA3GABRG2GABRB3
Delorazepam SCHEMBL6130036 0.81 LMNA (0.73) GABRA1GABRA5GABRA3GABRG2GABRB3
Alprazolam SCHEMBL3905590 0.81 GABRA1 (0.62) GABRA1GABRA5GABRA3GABRG2GABRB3
Clonazepam SCHEMBL20771795 0.80 GABRA1 (0.96) GABRA1GABRA5GABRA3GABRG2GABRB3

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015070873-A1 DETECTION OF SUBSTANCES IN LIQUIDS, IN PARTICULAR PSYCHOACTIVE SUBSTANCES DRUGSTER APS (DK) 2015-05-21 WO disclosed