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Name | C-C chemokine receptor type 9 |
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Species | Homo sapiens (Human) |
Gene | CCR9 |
Synonym | CC-CKR-9 GPR28 GPR-9-6 GPR 9-6 G-protein coupled receptor 28 [ Show all ] |
Disease | Crohn's disease Sjogren's syndrome |
Length | 369 |
Amino acid sequence | MTPTDFTSPIPNMADDYGSESTSSMEDYVNFNFTDFYCEKNNVRQFASHFLPPLYWLVFIVGALGNSLVILVYWYCTRVKTMTDMFLLNLAIADLLFLVTLPFWAIAAADQWKFQTFMCKVVNSMYKMNFYSCVLLIMCISVDRYIAIAQAMRAHTWREKRLLYSKMVCFTIWVLAAALCIPEILYSQIKEESGIAICTMVYPSDESTKLKSAVLTLKVILGFFLPFVVMACCYTIIIHTLIQAKKSSKHKALKVTITVLTVFVLSQFPYNCILLVQTIDAYAMFISNCAVSTNIDICFQVTQTIAFFHSCLNPVLYVFVGERFRRDLVKTLKNLGCISQAQWVSFTRREGSLKLSSMLLETTSGALSL |
UniProt | P51686 |
Protein Data Bank | 5lwe |
GPCR-HGmod model | P51686 |
3D structure model | This structure is from PDB ID 5lwe. |
BioLiP | BL0364069,BL0364071, BL0364070 |
Therapeutic Target Database | T97873 |
ChEMBL | CHEMBL5815 |
IUPHAR | 66 |
DrugBank | N/A |
Name | CHEMBL3718094 |
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Molecular formula | C28H31ClN4O5S |
IUPAC name | N-[4-chloro-2-(pyridine-4-carbonyl)phenyl]-4-[4-[(4R,5R)-2,4,5-trimethyl-1,3-dioxolan-2-yl]piperazin-1-yl]benzenesulfonamide |
Molecular weight | 571.089 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 1 |
XlogP | 4.6 |
Synonyms | N/A |
Inchi Key | JAIIDNMTTHBYDA-WOJBJXKFSA-N |
Inchi ID | InChI=1S/C28H31ClN4O5S/c1-19-20(2)38-28(3,37-19)33-16-14-32(15-17-33)23-5-7-24(8-6-23)39(35,36)31-26-9-4-22(29)18-25(26)27(34)21-10-12-30-13-11-21/h4-13,18-20,31H,14-17H2,1-3H3/t19-,20-/m1/s1 |
PubChem CID | 127024543 |
ChEMBL | CHEMBL3718094 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | <1000.0 nM | None | ChEMBL |
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