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Name | C-C chemokine receptor type 6 |
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Species | Homo sapiens (Human) |
Gene | CCR6 |
Synonym | DRY6 G-protein coupled receptor 29 GPR-CY4 GPR29 GPRCY4 [ Show all ] |
Disease | N/A |
Length | 374 |
Amino acid sequence | MSGESMNFSDVFDSSEDYFVSVNTSYYSVDSEMLLCSLQEVRQFSRLFVPIAYSLICVFGLLGNILVVITFAFYKKARSMTDVYLLNMAIADILFVLTLPFWAVSHATGAWVFSNATCKLLKGIYAINFNCGMLLLTCISMDRYIAIVQATKSFRLRSRTLPRSKIICLVVWGLSVIISSSTFVFNQKYNTQGSDVCEPKYQTVSEPIRWKLLMLGLELLFGFFIPLMFMIFCYTFIVKTLVQAQNSKRHKAIRVIIAVVLVFLACQIPHNMVLLVTAANLGKMNRSCQSEKLIGYTKTVTEVLAFLHCCLNPVLYAFIGQKFRNYFLKILKDLWCVRRKYKSSGFSCAGRYSENISRQTSETADNDNASSFTM |
UniProt | P51684 |
Protein Data Bank | N/A |
GPCR-HGmod model | P51684 |
3D structure model | This predicted structure model is from GPCR-EXP P51684. |
BioLiP | N/A |
Therapeutic Target Database | N/A |
ChEMBL | CHEMBL4423 |
IUPHAR | N/A |
DrugBank | N/A |
Name | MLS001180103 |
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Molecular formula | C16H15N3O2S |
IUPAC name | N-[[(4-methylbenzoyl)amino]carbamothioyl]benzamide |
Molecular weight | 313.375 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 3 |
XlogP | 3.5 |
Synonyms | ARONIS003396 MCULE-5981029631 N-{[2-(4-methylbenzoyl)hydrazino]carbonothioyl}benzamide N-({2-[(4-methylphenyl)carbonyl]hydrazinyl}carbonothioyl)benzamide SMR000477082 [ Show all ] |
Inchi Key | FMEMNCREVJAVHG-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C16H15N3O2S/c1-11-7-9-13(10-8-11)15(21)18-19-16(22)17-14(20)12-5-3-2-4-6-12/h2-10H,1H3,(H,18,21)(H2,17,19,20,22) |
PubChem CID | 1788711 |
ChEMBL | CHEMBL1435343 |
IUPHAR | N/A |
BindingDB | 80034 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | 30200.0 nM | , PubChem BioAssay data set | BindingDB,ChEMBL |
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