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GPCR

Name	Cholecystokinin receptor type A
Species	Rattus norvegicus (Rat)
Gene	Cckar
Synonym	CCK-A receptor CCK-AR CCK1 receptor CCK1-R cholecystokinin receptor type A cholecystokinin-1 receptor [ Show all ]
Disease	N/A for non-human GPCRs
Length	444
Amino acid sequence	MSHSPARQHLVESSRMDVVDSLLMNGSNITPPCELGLENETLFCLDQPQPSKEWQSALQILLYSIIFLLSVLGNTLVITVLIRNKRMRTVTNIFLLSLAVSDLMLCLFCMPFNLIPNLLKDFIFGSAVCKTTTYFMGTSVSVSTFNLVAISLERYGAICRPLQSRVWQTKSHALKVIAATWCLSFTIMTPYPIYSNLVPFTKNNNQTANMCRFLLPSDAMQQSWQTFLLLILFLLPGIVMVVAYGLISLELYQGIKFDASQKKSAKEKKPSTGSSTRYEDSDGCYLQKSRPPRKLELQQLSSGSGGSRLNRIRSSSSAANLIAKKRVIRMLIVIVVLFFLCWMPIFSANAWRAYDTVSAEKHLSGTPISFILLLSYTSSCVNPIIYCFMNKRFRLGFMATFPCCPNPGPPGVRGEVGEEEDGRTIRALLSRYSYSHMSTSAPPP
UniProt	P30551
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL2871
IUPHAR	76
DrugBank	N/A

Ligand

Name	clonazepam
Molecular formula	C15H10ClN3O3
IUPAC name	5-(2-chlorophenyl)-7-nitro-1,3-dihydro-1,4-benzodiazepin-2-one
Molecular weight	315.713
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	2.4
Synonyms	Clonazepamum DEA No. 2737 1622-61-3 HMS2093H22 5-(2-Chlorophenyl)-1,3-dihydro-7-nitro-2H-1,4-benzodiazepin-2-one Kenoket 5-(o-Chlorophenyl)-1,3-dihydro-7-nitro-2H-1,4-benzodiazepin-2-one LS-34260 7-nitro-1,3-dihydro-5-(o-chlorophenyl)-2H-1,4-benzodiazepin-2-one Paxam AN-49558 Ro 4-8180 BRN 0759557 SBI-0206863.P001 Chlonazepam ZINC3813003 Clonazepam solution, 1.0 mg/mL in methanol, ampule of 1 mL, certified reference material Clonopin DivK1c_000973 2H-1, 5-(2-chlorophenyl)-1,3-dihydro-7-nitro- I14-1364 5-(2-Chlorophenyl)-7-nitro-1,3-dihydro-2H-1,4-benzodiazepin-2-one Klonopin Rapidly Disintegrating 5-(o-Chlorophenyl)-7-nitro-1H-1,4-benzodiazepin-2(3H)-one NINDS_000973 AB01563349_01 Rivatril Apetryl Ro 5-4023/B-7 CC-25924 Solfidin Clonazepam (JP15/USP/INN) Clonazepam [USAN:INN:BAN:JAN] D0CP4E 1,4.benzodiazepin-2-one FT-0603203 2H-1,4-Benzodiazepin-2-one, 5-(o-chlorophenyl)-1,3-dihydro-7-nitro- Jsp003251 5-(2-chlorophenyl)-7-nitro-2,3-dihydro-1H-1,4-benzodiazepin-2-one Lonazep 5PE9FDE8GB NSC179913 AKOS015902192 Rivotril BDBM50019213 Ro-54023 UNII-5PE9FDE8GB Clonazepam 1.0 mg/ml in Methanol Clonazepam, powder Clonazepamum [INN-Latin] DF2374250 2-H-1, 5-(o-chlorophenyl)-1,3-dihydro-7-nitro- HMS503C07 5-(2-Chlorophenyl)-1,4-benzodiazepin-2-one Klonopin 5-(o-Chlorophenyl)-1,4-benzodiazepin-2-one Melzap 7-Nitro-5-(2-chlorophenyl)-3H-1,4-benzodiazepin-2(1H)-one Ravotril Antelepsin Ro 4023 C-19452 SCHEMBL38899 Cloazepam Clonazepam solution, drug standard, 1.0 mg/mL in methanol CTK4A4881 1,3-Dihydro-5-(o-chlorophenyl)-7-nitro-3H-1,4-benzodiazepin-2-one DTXSID1022845 2H-1, 5-(o-chlorophenyl)-1,3-dihydro-7-nitro- IDI1_000973 5-(2-Chlorophenyl)-7-nitro-1,3-dihydro-2H-1,4-benzodiazepin-2-one # Landsen 5-24-04-00351 (Beilstein Handbook Reference) NSC 179913 AC-15733 Rivatril (TN) BAS 00308658 Ro 54023 CCG-213669 SR-01000937610 Clonazepam (JP17/USP/INN) Clonazepam [USAN:USP:INN:BAN:JAN] clonazepam--dea schedule iv item DB01068 106955-87-7 GTPL6963 5-(2-Chloro-phenyl)-7-nitro-1,3-dihydro-benzo[e][1,4]diazepin-2-one KBio1_000973 5-(2-Chlorophenyl)-7-nitro-3H-1,4-benzodiazepin-2(1H)-one LS-34156 622C613 Oprea1_168772 Alti-Clonazepam Rivotril (TN) BIDD:PXR0144 RO4023 CHEMBL452 WLN: T67 GMV JN IHJ CNW KR BG Clonazepam fine granules (JP17) Clonex DGBIGWXXNGSACT-UHFFFAOYSA-N 2-H-1,4-Benzodiazepin-2-one, 5-(o-chlorophenyl)-1,3-dihydro-7-nitro- HSDB 3265 5-(2-chlorophenyl)-7-nitro-1,3-dihydro-1,4-benzodiazepin-2-one Klonopin (TN) 5-(o-chlorophenyl)-7-nitro-1,3-dihydro-2H-1,4-benzodiazepin-2-one MLS003899214 A810362 Ravotril (TN) Antilepsin Ro 5-4023 C15H10ClN3O3 SMR000058982 Clonazepam tablets (JP17) D00280 1,3-Dihydro-7-nitro-5-(2-chlorophenyl)-2H-1,4.benzodiazepin-2-one EINECS 216-596-2 2H-1,4-Benzodiazepin-2-one, 5-(2-chlorophenyl)-1,3-dihydro-7-nitro- Iktorivil 5-(2-chlorophenyl)-7-nitro-1H-benzo[e][1,4]diazepin-2(3H)-one Lktorivil NSC-179913 AC1L1EI2 Rivoril BC209470 Ro-5-4023 CHEBI:3756 SR-01000937610-2 Clonazepam 0.1 mg/ml in Methanol Clonazepam, European Pharmacopoeia (EP) Reference Standard [ Show all ]
Inchi Key	DGBIGWXXNGSACT-UHFFFAOYSA-N
Inchi ID	InChI=1S/C15H10ClN3O3/c16-12-4-2-1-3-10(12)15-11-7-9(19(21)22)5-6-13(11)18-14(20)8-17-15/h1-7H,8H2,(H,18,20)
PubChem CID	2802
ChEMBL	CHEMBL452
IUPHAR	N/A
BindingDB	50019213
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
IC50	<100000.0 nM	PMID2848124	BindingDB,ChEMBL

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