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Name | Gastrin/cholecystokinin type B receptor |
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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 [ Show all ] |
Disease | Diagnostic imaging Duodenal ulcers Gastroesophageal reflux disease Gastrointestinal disease Intestine 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 |
Name | CHEMBL566177 |
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Molecular formula | C25H18BrCl2FN4O5S |
IUPAC name | methyl (2S)-3-(3-bromo-4-fluorophenyl)-2-[[4,5-dichloro-2-(quinoxalin-5-ylsulfonylamino)benzoyl]amino]propanoate |
Molecular weight | 656.304 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 2 |
XlogP | 5.5 |
Synonyms | SCHEMBL3754073 AICFYCNTUWZWAG-NRFANRHFSA-N (S)-3-(3-Bromo-4-fluoro-phenyl)-2-[4,5-dichloro-2-(quinoxaline-5-sulfonylamino)-benzoylamino]-propionic acid methyl ester BDBM50415075 |
Inchi Key | AICFYCNTUWZWAG-NRFANRHFSA-N |
Inchi ID | InChI=1S/C25H18BrCl2FN4O5S/c1-38-25(35)21(10-13-5-6-18(29)15(26)9-13)32-24(34)14-11-16(27)17(28)12-20(14)33-39(36,37)22-4-2-3-19-23(22)31-8-7-30-19/h2-9,11-12,21,33H,10H2,1H3,(H,32,34)/t21-/m0/s1 |
PubChem CID | 45486947 |
ChEMBL | CHEMBL566177 |
IUPHAR | N/A |
BindingDB | 50415075 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
Parameter | Value | Reference | Database source |
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Ki | 251.19 nM | PMID19815410 | BindingDB,ChEMBL |
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