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Name | Somatostatin receptor type 4 |
---|---|
Species | Homo sapiens (Human) |
Gene | SSTR4 |
Synonym | SS4R SS4-R SS-4-R SRIF2B SST4 receptor |
Disease | N/A |
Length | 388 |
Amino acid sequence | MSAPSTLPPGGEEGLGTAWPSAANASSAPAEAEEAVAGPGDARAAGMVAIQCIYALVCLVGLVGNALVIFVILRYAKMKTATNIYLLNLAVADELFMLSVPFVASSAALRHWPFGSVLCRAVLSVDGLNMFTSVFCLTVLSVDRYVAVVHPLRAATYRRPSVAKLINLGVWLASLLVTLPIAIFADTRPARGGQAVACNLQWPHPAWSAVFVVYTFLLGFLLPVLAIGLCYLLIVGKMRAVALRAGWQQRRRSEKKITRLVLMVVVVFVLCWMPFYVVQLLNLFVTSLDATVNHVSLILSYANSCANPILYGFLSDNFRRFFQRVLCLRCCLLEGAGGAEEEPLDYYATALKSKGGAGCMCPPLPCQQEALQPEPGRKRIPLTRTTTF |
UniProt | P31391 |
Protein Data Bank | N/A |
GPCR-HGmod model | P31391 |
3D structure model | This predicted structure model is from GPCR-EXP P31391. |
BioLiP | N/A |
Therapeutic Target Database | N/A |
ChEMBL | CHEMBL1853 |
IUPHAR | 358 |
DrugBank | BE0009273 |
Name | CHEMBL436962 |
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Molecular formula | C61H78N12O14S2 |
IUPAC name | (4R,7S,10R,13S,16R,19S,22S,25S,28R,31S)-31-amino-19-(4-aminobutyl)-13,25,28-tribenzyl-10,16-bis[(1R)-1-hydroxyethyl]-7-(hydroxymethyl)-22-(1H-indol-3-ylmethyl)-6,9,12,15,18,21,24,27,30-nonaoxo-1,2-dithia-5,8,11,14,17,20,23,26,29-nonazacyclodotriacontane-4-carboxylic acid |
Molecular weight | 1267.48 |
Hydrogen bond acceptor | 18 |
Hydrogen bond donor | 16 |
XlogP | 0.1 |
Synonyms | Des-AA1,2,4,5-[D-Trp8]SRIF BDBM50159458 D0J5OY |
Inchi Key | CGHVCXMPDMMIFL-JFJBRMBESA-N |
Inchi ID | InChI=1S/C61H78N12O14S2/c1-34(75)50-59(84)69-46(28-38-20-10-5-11-21-38)57(82)73-51(35(2)76)60(85)70-48(31-74)58(83)71-49(61(86)87)33-89-88-32-41(63)52(77)66-44(26-36-16-6-3-7-17-36)54(79)67-45(27-37-18-8-4-9-19-37)55(80)68-47(29-39-30-64-42-23-13-12-22-40(39)42)56(81)65-43(53(78)72-50)24-14-15-25-62/h3-13,16-23,30,34-35,41,43-51,64,74-76H,14-15,24-29,31-33,62-63H2,1-2H3,(H,65,81)(H,66,77)(H,67,79)(H,68,80)(H,69,84)(H,70,85)(H,71,83)(H,72,78)(H,73,82)(H,86,87)/t34-,35-,41-,43+,44-,45+,46+,47+,48+,49+,50-,51-/m1/s1 |
PubChem CID | 44388022 |
ChEMBL | CHEMBL436962 |
IUPHAR | N/A |
BindingDB | 50159458 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has more than 5 hydrogen bond donor. This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | 3.3 nM | PMID15658865 | BindingDB,ChEMBL |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417