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GLASS

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GPCR

Name	Gastrin/cholecystokinin type B receptor
Species	Homo sapiens (Human)
Gene	CCKBR
Synonym	CCK-B receptor CCK-B receptor {ECO:0000303\|PubMed:8415658} CCK-B/gastrin receptor CCK-BR gastrin/cholecystokinin type B receptor CCK2 receptor CCK2-R CHOLREC Cholecystokinin-2 receptor {ECO:0000303\|PubMed:11926817} cholecystokinin-2 receptor [ Show all ]
Disease	Diagnostic imaging Duodenal ulcers Gastroesophageal reflux disease Gastrointestinal disease Intestine cancer Medullary thyroid cancer Stomach disease Stomach ulcer Type 1 diabetes Ulcerative colitis Unspecified Anxiety disorder Caerulein stimulated gastric and pancreatic secretion Cancer [ Show all ]
Length	447
Amino acid sequence	MELLKLNRSVQGTGPGPGASLCRPGAPLLNSSSVGNLSCEPPRIRGAGTRELELAIRITLYAVIFLMSVGGNMLIIVVLGLSRRLRTVTNAFLLSLAVSDLLLAVACMPFTLLPNLMGTFIFGTVICKAVSYLMGVSVSVSTLSLVAIALERYSAICRPLQARVWQTRSHAARVIVATWLLSGLLMVPYPVYTVVQPVGPRVLQCVHRWPSARVRQTWSVLLLLLLFFIPGVVMAVAYGLISRELYLGLRFDGDSDSDSQSRVRNQGGLPGAVHQNGRCRPETGAVGEDSDGCYVQLPRSRPALELTALTAPGPGSGSRPTQAKLLAKKRVVRMLLVIVVLFFLCWLPVYSANTWRAFDGPGAHRALSGAPISFIHLLSYASACVNPLVYCFMHRRFRQACLETCARCCPRPPRARPRALPDEDPPTPSIASLSRLSYTTISTLGPG
UniProt	P32239
Protein Data Bank	N/A
GPCR-HGmod model	P32239
3D structure model	This predicted structure model is from GPCR-EXP P32239.
BioLiP	N/A
Therapeutic Target Database	T05849
ChEMBL	CHEMBL298
IUPHAR	77
DrugBank	BE0001158

Ligand

Name	proglumide
Molecular formula	C18H26N2O4
IUPAC name	4-benzamido-5-(dipropylamino)-5-oxopentanoic acid
Molecular weight	334.416
Hydrogen bond acceptor	4
Hydrogen bond donor	2
XlogP	2.4
Synonyms	Pharmakon1600-01501119 D01818 DTXSID7023516 Promide (parasympatholytic) HMS1568P21 SMR001233513 HMS502C06 (RS)-proglumide KBio2_006948 4-benzamido-5-(dipropylamino)-5-oxopentanoic acid LS-71949 N(2)-benzoyl-N,N-dipropyl-alpha-glutamine Spectrum5_001591 AN-15100 NCGC00015623-07 TC-146874 BPBio1_000351 NINDS_000684 W-5219 CCG-39024 Prestwick2_000240 DivK1c_000684 Proglumide [USAN:INN:BAN:JAN] FT-0654938 SBB058173 HMS2095P21 IDI1_000684 25727-74-6 KBioSS_001812 4-Benzoylamino-5-dipropylamino-5-oxopentanoic acid Midelid SPBio_002240 AC-1274 N2-Benzoyl-N,N-dipropyl-alpha-glutamine SR-01000002970-2 API0007251 NCGC00094163-01 Tox21_110557_1 BRN 4151696 Nulsa Xylamide CS-8029 Proglumida DSSTox_GSID_23516 Proglumidum [INN-Latin] GTPL893 SCHEMBL19994752 HMS3369D14 (+-)-4-Benzamido-N,N-dipropylglutaramic acid KBio2_001812 4-(N,N-dipropylcarbamoyl)-4-(phenylcarbonylamino)butanoic acid Lopac0_000832 620P606 MLS002154246 Spectrum3_001444 AK-87654 NCGC00015623-05 ST24043276 BDBM50014888 NCGC00094163-04 W 5219 C18H26N2O4 Pentanoic acid, 4-(benzoylamino)-5-(dipropylamino)-5-oxo- Prestwick0_000240 D04HQT Proglumide (JP17/USAN/INN) EINECS 229-567-4 rac-N(2)-benzoyl-N,N-dipropyl-alpha-glutamine HMS1921F19 HY-B1330 242 DL KBio3_002407 4-Benzamido-N,N-dipropylglutaramic acid M-001 AB00052206 N-Benzoyl-N',N'-dipropyl-DL-isoglutamine Sodium-Potassium salt Spectrum_001332 ANW-58129 NCGC00015623-10 TL8004691 BRD-A44863528-001-05-8 NSC-757841 Xilamide CHEBI:32058 CHEMBL316561 Prestwick3_000240 dl-proglumide Proglumide,(S) Gastrotopic SBI-0050809.P003 HMS2235B24 KB-240288 4-(benzoylamino)-5-(dipropylamino)-5-oxopentanoic acid KS-1212 4-BENZOYLAMINO-5-DIPROPYLAMINO-5-OXOPENTANOIC ACID SODIUM SALT Milid SPECTRUM1501119 AC1L1J8S NCGC00015623-03 SR-01000002970-4 AX8149133 NCGC00094163-02 Tox21_500832 BSPBio_000319 Nulsa (TN) Xylamide (gastroprotective agent) CTK8B7675 Proglumida [INN-Spanish] DSSTox_RID_77060 Progumide H786 SCHEMBL93339 HMS3712P21 (+-)-proglumide KBio2_004380 4-benzamido-5-(dipropylamino)-5-oxo-pentanoic acid LP00832 6620-60-6 MolPort-003-666-356 Spectrum4_000425 AKOS015895810 NCGC00015623-06 ST51015098 Binoside NCGC00261517-01 W-104770 CAS-6620-60-6 Pentanoic acid, 4-(benzoylamino)-5-(dipropylamino)-5-oxo-, (+-)- Prestwick1_000240 DGMKFQYCZXERLX-UHFFFAOYSA-N Proglumide [USAN:BAN:INN:JAN] EU-0100832 racemic proglumide HMS2092D13 I06-1540 24485-90-3 KBioGR_000750 4-Benzoylamino-4-dipropylcarbamoyl-butyric acid MCULE-2438450007 SPBio_001452 AB00052206_08 N2-(phenylcarbonyl)-N,N-dipropyl-a-glutamine SR-01000002970 AOB5334 NCGC00016676-01 Tox21_110557 BRD-A44863528-001-08-2 NSC757841 Xyde CHEBI:76266 CR 242 Prestwick_602 DSSTox_CID_3516 Proglumidum Glutaramic acid, 4-benzamido-N,N-dipropyl-, DL- SC-18334 HMS3262H05 KBio1_000684 4-(Benzoylamino)-5-(dipropylamino)-5-oxovaleric acid KXM Milide Spectrum2_001406 AC1Q5KVC NCGC00015623-04 SR-01000002970-7 BC207728 NCGC00094163-03 Ulcutin BSPBio_002907 N~2~-(phenylcarbonyl)-N,N-dipropyl-alpha-glutamine [ Show all ]
Inchi Key	DGMKFQYCZXERLX-UHFFFAOYSA-N
Inchi ID	InChI=1S/C18H26N2O4/c1-3-12-20(13-4-2)18(24)15(10-11-16(21)22)19-17(23)14-8-6-5-7-9-14/h5-9,15H,3-4,10-13H2,1-2H3,(H,19,23)(H,21,22)
PubChem CID	4922
ChEMBL	CHEMBL316561
IUPHAR	893
BindingDB	50014888
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	900000.0 nM	PMID2299627	BindingDB,ChEMBL
IC50	2500000.0 nM	PMID3572963	BindingDB,ChEMBL

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