Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Gastric inhibitory polypeptide receptor' and Ligand = 'BDBM50275578'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Gastric inhibitory polypeptide receptor (Homo sapiens (Human))	BDBM50275578 (CHEMBL4128112) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CS)C(N)=O |r| Show InChI InChI=1S/C143H223N37O44S2/c1-15-74(10)115(140(221)163-89(42-46-112(191)192)126(207)169-95(58-80-61-150-83-32-20-19-31-81(80)83)132(213)167-90(53-70(2)3)128(209)156-76(12)118(199)155-75(11)117(198)152-62-108(186)151-64-110(188)177-49-25-35-102(177)138(219)173-99(67-183)136(217)171-97(65-181)121(202)153-63-109(187)154-78(14)141(222)179-51-27-37-104(179)143(224)180-52-28-38-105(180)142(223)178-50-26-36-103(178)139(220)174-100(68-225)116(149)197)176-134(215)94(57-79-29-17-16-18-30-79)168-129(210)92(55-72(6)7)165-123(204)84(33-21-23-47-144)158-119(200)77(13)157-137(218)101(69-226)175-127(208)87(40-44-107(148)185)161-124(205)88(41-45-111(189)190)162-133(214)96(60-114(195)196)170-130(211)93(56-73(8)9)166-125(206)86(39-43-106(147)184)160-122(203)85(34-22-24-48-145)159-135(216)98(66-182)172-131(212)91(54-71(4)5)164-120(201)82(146)59-113(193)194/h16-20,29-32,61,70-78,82,84-105,115,150,181-183,225-226H,15,21-28,33-60,62-69,144-146H2,1-14H3,(H2,147,184)(H2,148,185)(H2,149,197)(H,151,186)(H,152,198)(H,153,202)(H,154,187)(H,155,199)(H,156,209)(H,157,218)(H,158,200)(H,159,216)(H,160,203)(H,161,205)(H,162,214)(H,163,221)(H,164,201)(H,165,204)(H,166,206)(H,167,213)(H,168,210)(H,169,207)(H,170,211)(H,171,217)(H,172,212)(H,173,219)(H,174,220)(H,175,208)(H,176,215)(H,189,190)(H,191,192)(H,193,194)(H,195,196)/t74-,75-,76-,77-,78-,82-,84-,85-,86-,87-,88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,115-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a
Sanofi-Aventis Deutschland GmbH Curated by ChEMBL					Assay Description Agonist activity at human GIP receptor expressed in HEK293 cells assessed as cAMP accumulation after 30 mins by HTRF assay				J Med Chem 61: 5580-5593 (2018) Article DOI: 10.1021/acs.jmedchem.8b00292 BindingDB Entry DOI: 10.7270/Q2NP26XR
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