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BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP TM-fold DECOYS POTENTIAL RW/RWplus HPSF THE-DB CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13

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GPCR

NameHydroxycarboxylic acid receptor 3
SpeciesHomo sapiens (Human)
GeneHCAR3
SynonymG-protein coupled receptor 109B
Nicotinic acid receptor 2
Nic2
NIACR2
Niacin receptor 2
[ Show all ]
DiseaseN/A
Length387
Amino acid sequenceMNRHHLQDHFLEIDKKNCCVFRDDFIAKVLPPVLGLEFIFGLLGNGLALWIFCFHLKSWKSSRIFLFNLAVADFLLIICLPFVMDYYVRRSDWKFGDIPCRLVLFMFAMNRQGSIIFLTVVAVDRYFRVVHPHHALNKISNWTAAIISCLLWGITVGLTVHLLKKKLLIQNGTANVCISFSICHTFRWHEAMFLLEFFLPLGIILFCSARIIWSLRQRQMDRHAKIKRAITFIMVVAIVFVICFLPSVVVRIHIFWLLHTSGTQNCEVYRSVDLAFFITLSFTYMNSMLDPVVYYFSSPSFPNFFSTLINRCLQRKITGEPDNNRSTSVELTGDPNKTRGAPEALIANSGEPWSPSYLGPTSNNHSKKGHCHQEPASLEKQLGCCIE
UniProtP49019
Protein Data BankN/A
GPCR-HGmod modelP49019
3D structure modelThis predicted structure model is from GPCR-EXP P49019.
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL4421
IUPHAR313
DrugBankBE0000836

Known ligands

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Total entries: 159
Page:  / 2 

GLASS IDMoleculeFormulaMolecular weightH-bond acceptor / donorXlogPLipinski's druglikeness
272D structure6-n-butylamino-3-pyridine carboxylic acidC10H14N2O2194.2344 / 21.9Yes
16422D structure4-(dipropylamino)-3-nitrobenzoic acidC13H18N2O4266.2975 / 13.2Yes
32492D structureCHEMBL238385C10H14N2O3210.2335 / 21.0Yes
37602D structureCHEMBL3299115C18H19NO5329.3525 / 22.8Yes
55292D structureCHEMBL559204C14H13N3O2S2319.3976 / 22.9Yes
71592D structureCHEMBL1224147C16H14FN3O2299.3055 / 11.9Yes
72882D structureCHEMBL238387C10H14N2O2194.2344 / 11.7Yes
86342D structureCHEMBL223700C12H8F2O4254.1896 / 11.9Yes
125192D structureSCH-900271C14H16N2O4276.2924 / 21.6Yes
171602D structure1-cyclobutyl-1H-benzotriazole-5-carboxylic acidC11H11N3O2217.2284 / 11.8Yes
184092D structureCHEMBL385103C12H8F2O4254.1896 / 11.9Yes
255232D structure6-(cyclopropylamino)pyridine-3-carboxylic acidC9H10N2O2178.1914 / 21.3Yes
314302D structureCHEMBL1672639C15H16F2N2O3310.3016 / 12.7Yes
320012D structureCHEMBL202206C11H13N3O2219.2444 / 11.8Yes
327142D structureCHEMBL238375C11H14N2O4238.2435 / 12.3Yes
354192D structureCHEMBL560254C10H17N3O2211.2654 / 22.3Yes
391802D structureCHEMBL561720C12H17N3O2235.2874 / 22.0Yes
423742D structure5-isopropyl-1H-pyrazole-3-carboxylic acidC7H10N2O2154.1693 / 21.2Yes
450862D structure4-(allylamino)-3-nitrobenzoic acidC10H10N2O4222.25 / 22.5Yes
460662D structure4-(cyclopentylamino)-3-nitrobenzoic acidC12H14N2O4250.2545 / 23.1Yes
461972D structureCHEMBL202657C14H9F2N3O2289.2426 / 12.4Yes
5534632D structureD-phenylalanineC9H11NO2165.1923 / 2-1.5Yes
489842D structureCHEMBL562675C14H13N3O2S2319.3976 / 23.0Yes
531922D structureCHEMBL2036951C11H10F2N2O4272.2086 / 20.6Yes
568102D structureCHEMBL374111C12H9ClO4252.654 / 12.3Yes
584662D structureACIFRANC12H10O4218.2084 / 11.7Yes
586602D structureCHEMBL1671877C14H14F2N2O3296.2746 / 12.3Yes
601612D structureCHEMBL561920C18H17N3O2307.3534 / 23.5Yes
617372D structureACIPIMOXC6H6N2O3154.1254 / 1-1.0Yes
661282D structure4-(sec-butylamino)-3-nitrobenzoic acidC11H14N2O4238.2435 / 23.1Yes
718912D structure1-Benzyl-1,2,3-benzotriazole-5-carboxylic acidC14H11N3O2253.2614 / 12.2Yes
761832D structureCHEMBL397055C6H7FN6182.1625 / 20.4Yes
846722D structureCHEMBL393064C7H10N6178.1994 / 20.7Yes
918512D structureCHEMBL550153C14H13N3O3S303.3366 / 22.3Yes
974092D structureCHEMBL220001C13H9F3O4286.2067 / 12.6Yes
993212D structure1-Cyclohexyl-1H-benzotriazole-5-carboxylic acidC13H15N3O2245.2824 / 12.6Yes
1018712D structureCHEMBL383367C20H15N3O2329.3594 / 13.9Yes
1021252D structureCHEMBL562933C14H25N3O2267.3734 / 23.9Yes
1037822D structureCHEMBL223140C10H8O4S224.235 / 11.4Yes
1124432D structureCHEMBL201048C12H15N3O2233.2714 / 12.7Yes
1166662D structureCHEMBL2036813C11H12N2O4236.2274 / 20.7Yes
1235352D structureCHEMBL439028C14H10N2O5286.2435 / 22.3Yes
1244892D structureCHEMBL219950C14H14O4246.2624 / 12.5Yes
1259202D structureCHEMBL373880C10H8O5208.1695 / 10.8Yes
1276902D structure6-(dipropylamino)nicotinic acidC12H18N2O2222.2884 / 12.6Yes
1328872D structureCHEMBL3299016C19H17ClN2O3356.8064 / 24.3Yes
1329412D structureCHEMBL223623C11H10O4S238.2575 / 11.8Yes
1356532D structure4-(cyclopropylamino)-3-nitrobenzoic acidC10H10N2O4222.25 / 22.4Yes
1384472D structureCHEMBL3299014C22H24N2O6412.4427 / 23.3Yes
1458332D structureCHEMBL1224070C16H14ClN3O3331.7565 / 13.0Yes
1462852D structureCHEMBL552399C9H15N3O2197.2384 / 32.1Yes
1472982D structure1-Propyl-1,2,3-benzotriazole-5-carboxylic acidC10H11N3O2205.2174 / 11.7Yes
1474992D structureCHEMBL3299011C19H18N2O3322.3644 / 23.3Yes
1484252D structureCHEMBL2036954C13H14N2O4262.2654 / 21.2Yes
5540332D structure2-Hydroxyoctanoic acidC8H16O3160.2133 / 22.0Yes
1570292D structureCHEMBL221282C10H7ClO4S258.6725 / 12.3Yes
1591622D structureCHEMBL553415C8H13N3O2183.2114 / 31.7Yes
1595372D structureCHEMBL564914C16H15N3O2S313.3755 / 23.2Yes
1617762D structure6-(diethylamino)pyridine-3-carboxylic acidC10H14N2O2194.2344 / 11.6Yes
1687092D structureCHEMBL202427C15H13N3O3283.2875 / 12.2Yes
1694662D structureCHEMBL3297873C19H20N2O3324.384 / 23.1Yes
1707832D structureCHEMBL373752C13H12O5248.2345 / 11.6Yes
1762202D structureCHEMBL553912C16H29N3O2295.4274 / 25.2No
1771432D structure4-(methylamino)-3-nitrobenzoic acidC8H8N2O4196.1625 / 21.9Yes
1843992D structureCHEMBL3299116C18H21NO5331.3685 / 23.0Yes
1848992D structureCHEMBL375754C11H12O4208.2134 / 11.2Yes
1924382D structureCHEMBL394468C9H10N2O2178.1914 / 21.3Yes
2004302D structure6-(cyclobutylamino)nicotinic acidC10H12N2O2192.2184 / 21.6Yes
2020902D structureCHEMBL3298703C21H21NO3335.4033 / 24.1Yes
2047772D structureCHEMBL557298C20H21N3O2335.4074 / 24.4Yes
2079082D structure3-nitro-4-(pyrrolidin-1-yl)benzoic acidC11H12N2O4236.2275 / 11.9Yes
2103372D structureCHEMBL3297875C20H21ClN2O4388.8485 / 24.1Yes
2182052D structureCHEMBL396382C11H16N2O2208.2614 / 22.5Yes
5543702D structure(3S)-3-hydroxyoctanoic acidC8H16O3160.2133 / 21.4Yes
2218222D structureCHEMBL376419C12H8F2O4254.1896 / 11.9Yes
2219902D structureCHEMBL2036955C13H14N2O4262.2654 / 21.2Yes
2240522D structureCHEMBL3299114C17H17NO5315.3255 / 22.9Yes
2241652D structureCHEMBL375625C12H8F2O4254.1896 / 11.9Yes
2255152D structureCHEMBL237077C12H16N2O4252.275 / 23.6Yes
2265912D structureCHEMBL222955C12H8Cl2O4287.0924 / 12.9Yes
2280142D structureCHEMBL424938C11H10O4S238.2575 / 11.8Yes
2293782D structureCHEMBL3297797C18H20ClNO5365.815 / 23.6Yes
2321322D structure6-(cyclopentylamino)nicotinic acidC11H14N2O2206.2454 / 22.0Yes
2325412D structure4-(isopropylamino)-3-nitrobenzoic acidC10H12N2O4224.2165 / 22.7Yes
2424162D structureCHEMBL424750C10H7ClO4S258.6725 / 12.4Yes
2449232D structure13426-16-9C12H10N2O2214.2244 / 22.3Yes
2485752D structure6-(isopropylamino)nicotinic acidC9H12N2O2180.2074 / 21.5Yes
2496112D structureCHEMBL3299113C18H17NO3295.3383 / 23.4Yes
2510822D structure3-nitro-4-(propylamino)benzoic acidC10H12N2O4224.2165 / 22.7Yes
2518512D structureCHEMBL3299015C20H20N2O4352.395 / 23.6Yes
2551442D structure4-(butylamino)-3-nitrobenzoic acidC11H14N2O4238.2435 / 23.1Yes
2586862D structure1-Cyclopentyl-1,2,3-benzotriazole-5-carboxylic acidC12H13N3O2231.2554 / 12.1Yes
2604062D structure691363-24-3C11H13N3O2219.2444 / 11.5Yes
2629622D structureCHEMBL396879C11H16N2O2208.2614 / 22.5Yes
2645662D structure4-(1-ETHYL-PROPYLAMINO)-3-NITRO-BENZOIC ACIDC12H16N2O4252.275 / 23.7Yes
2645702D structureCHEMBL564907C18H15F2N3O2343.3346 / 23.7Yes
2699652D structurenicotinic acidC6H5NO2123.1113 / 10.4Yes
2700042D structure6-benzamidonicotinic acidC13H10N2O3242.2344 / 21.5Yes
2715872D structureCHEMBL223566C11H10O4S238.2575 / 11.8Yes
2788952D structure6-(pentylamino)nicotinic acidC11H16N2O2208.2614 / 22.5Yes

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