You can:
Name | Sphingosine 1-phosphate receptor 3 |
---|---|
Species | Homo sapiens (Human) |
Gene | S1PR3 |
Synonym | Sphingosine 1-phosphate receptor Edg-3 S1P3 receptor S1P3 S1P receptor Edg-3 S1P receptor 3 [ Show all ] |
Disease | Breast cancer |
Length | 378 |
Amino acid sequence | MATALPPRLQPVRGNETLREHYQYVGKLAGRLKEASEGSTLTTVLFLVICSFIVLENLMVLIAIWKNNKFHNRMYFFIGNLALCDLLAGIAYKVNILMSGKKTFSLSPTVWFLREGSMFVALGASTCSLLAIAIERHLTMIKMRPYDANKRHRVFLLIGMCWLIAFTLGALPILGWNCLHNLPDCSTILPLYSKKYIAFCISIFTAILVTIVILYARIYFLVKSSSRKVANHNNSERSMALLRTVVIVVSVFIACWSPLFILFLIDVACRVQACPILFKAQWFIVLAVLNSAMNPVIYTLASKEMRRAFFRLVCNCLVRGRGARASPIQPALDPSRSKSSSSNNSSHSPKVKEDLPHTAPSSCIMDKNAALQNGIFCN |
UniProt | Q99500 |
Protein Data Bank | N/A |
GPCR-HGmod model | Q99500 |
3D structure model | This predicted structure model is from GPCR-EXP Q99500. |
BioLiP | N/A |
Therapeutic Target Database | T11241 |
ChEMBL | CHEMBL3892 |
IUPHAR | 277 |
DrugBank | N/A |
Name | SMR000015635 |
---|---|
Molecular formula | C16H17N3O2 |
IUPAC name | N-[4-(3,5-dimethylpyrazole-1-carbonyl)phenyl]cyclopropanecarboxamide |
Molecular weight | 283.331 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 1 |
XlogP | 2.2 |
Synonyms | 510717-70-1 CHEMBL1347845 MCULE-3676020637 N-{4-[(3,5-dimethylpyrazolyl)carbonyl]phenyl}cyclopropylcarboxamide AN-329/40989969 [ Show all ] |
Inchi Key | AJYNZXMQANAJHO-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C16H17N3O2/c1-10-9-11(2)19(18-10)16(21)13-5-7-14(8-6-13)17-15(20)12-3-4-12/h5-9,12H,3-4H2,1-2H3,(H,17,20) |
PubChem CID | 675735 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 37488 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | <49800.0 nM | N/A | BindingDB |
zhanglabzhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218