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GLASS

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Go to the GPCR, ligand, or experimental data tables.
Go to the experimental data table for text mining information in PubMed ID column.
Go to the GPCR page and check other ligands which interact with it.
Go to the ligand page and check other GPCRs which it interacts with.
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GPCR

Name	5-hydroxytryptamine receptor 6
Species	Rattus norvegicus (Rat)
Gene	Htr6
Synonym	5-HT-6 5-HT6 5-HT6 receptor 5-hydroxytryptamine (serotonin) receptor 6, G protein-coupled Serotonin receptor 6 ST-B17 [ Show all ]
Disease	N/A for non-human GPCRs
Length	436
Amino acid sequence	MVPEPGPVNSSTPAWGPGPPPAPGGSGWVAAALCVVIVLTAAANSLLIVLICTQPALRNTSNFFLVSLFTSDLMVGLVVMPPAMLNALYGRWVLARGLCLLWTAFDVMCCSASILNLCLISLDRYLLILSPLRYKLRMTAPRALALILGAWSLAALASFLPLLLGWHELGKARTPAPGQCRLLASLPFVLVASGVTFFLPSGAICFTYCRILLAARKQAVQVASLTTGTAGQALETLQVPRTPRPGMESADSRRLATKHSRKALKASLTLGILLGMFFVTWLPFFVANIAQAVCDCISPGLFDVLTWLGYCNSTMNPIIYPLFMRDFKRALGRFLPCVHCPPEHRPALPPPPCGPLTAVPDQASACSRCCLCLCRQTQIQTPLQGAPRACSSQPSFCCLERPPGTPRHPPGPPLWSTSLSQTLWSLRYGRIHSVPP
UniProt	P31388
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL3372
IUPHAR	11
DrugBank	N/A

Ligand

Name	Ro 04-6790
Molecular formula	C12H16N6O2S
IUPAC name	4-amino-N-[2,6-bis(methylamino)pyrimidin-4-yl]benzenesulfonamide
Molecular weight	308.36
Hydrogen bond acceptor	8
Hydrogen bond donor	4
XlogP	1.7
Synonyms	AC1NSM3L CCG-205122 JELFWSXQTXRMAJ-UHFFFAOYSA-N NCGC00015885-01 4-amino-N-(2,6-bis(methylamino)pyrimidin-4-yl)benzenesulfonamide 4-Amino-N-(2-methylamino-pyrimidin-4-yl)-benzenesulfonamide BCP02244 CHEMBL433461 Lopac-R-140 NCGC00015885-04 Ro-046790 4-amino-N-[2,6-bis(methylamino)pyrimidin-4-yl]benzenesulfonamide BPBio1_000551 FT-0748141 MolPort-023-276-598 PDSP1_001376 SCHEMBL678897 202466-68-0 4-Amino-N-(2,6-bis-dimethylamino-pyrimidin-4-yl)-benzenesulfonamide AKOS024457330 CHEBI:92762 KB-80392 NCGC00015885-02 Ro 4-6790 4-Amino-N-[2,6-bis(methylamino)-4-pyrimidinyl]-benzenesulfonamide BDBM50090528 CTK8E8508 Lopac0_001045 NCGC00162326-01 Ro04-6790 (4-amino-N-[2,6-bis(methylamino)-4-pyrimidinyl]-benzenesulfonamide) BRD-K43290182-001-01-9 GTPL274 N-(2,6-bis(methylamino)pyrimidin-4-yl)-4-aminobenzenesulfonamide PDSP2_001360 ZINC23472 4-Amino-N-(2,6-bis-methylamino-pyrimidin-4-yl)-benzenesulfonamide B7216 L000511 NCGC00015885-03 Ro-04-6790 4-Amino-N-[2,6-bis(methylamino)-4-pyrimidinyl]benzenesulfonamide Dihydrobromide Biomol-NT_000164 D0P8JA MFCD11045584 NCGC00162326-02 RT-015415 [ Show all ]
Inchi Key	JELFWSXQTXRMAJ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C12H16N6O2S/c1-14-10-7-11(17-12(15-2)16-10)18-21(19,20)9-5-3-8(13)4-6-9/h3-7H,13H2,1-2H3,(H3,14,15,16,17,18)
PubChem CID	5312145
ChEMBL	CHEMBL433461
IUPHAR	274
BindingDB	50090528
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Ki	25.1189 - 39.8107 nM	PMID9730917, PMID9647481	IUPHAR
Ki	28.84 nM	PMID14645659	BindingDB

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