Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Glucagon receptor' and Ligand = 'BDBM50266677'   

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
Glucagon receptor (Homo sapiens (Human))	BDBM50266677 (CHEMBL4080035) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCSC)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](CC(O)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1cnc[nH]1)[C@@H](C)O)[C@@H](C)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](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(N)=O |r| Show InChI InChI=1S/C145H225N45O47S/c1-11-71(6)114(141(235)174-89(39-43-110(203)204)127(221)178-95(54-77-60-161-81-31-19-18-30-79(77)81)131(225)175-91(50-69(2)3)129(223)168-83(33-21-23-46-147)124(218)179-96(56-107(152)200)120(214)162-62-108(153)201)189-135(229)93(52-75-26-14-12-15-27-75)177-133(227)97(57-111(205)206)180-126(220)87(37-41-105(150)198)166-117(211)72(7)165-121(215)84(34-24-47-159-144(154)155)167-123(217)85(35-25-48-160-145(156)157)170-139(233)102(66-193)186-134(228)99(59-113(209)210)181-128(222)90(44-49-238-10)173-125(219)88(38-42-106(151)199)172-122(216)82(32-20-22-45-146)169-138(232)101(65-192)185-130(224)92(51-70(4)5)176-132(226)98(58-112(207)208)182-140(234)103(67-194)187-143(237)116(74(9)196)190-136(230)94(53-76-28-16-13-17-29-76)183-142(236)115(73(8)195)188-109(202)63-163-119(213)86(36-40-104(149)197)171-137(231)100(64-191)184-118(212)80(148)55-78-61-158-68-164-78/h12-19,26-31,60-61,68-74,80,82-103,114-116,161,191-196H,11,20-25,32-59,62-67,146-148H2,1-10H3,(H2,149,197)(H2,150,198)(H2,151,199)(H2,152,200)(H2,153,201)(H,158,164)(H,162,214)(H,163,213)(H,165,215)(H,166,211)(H,167,217)(H,168,223)(H,169,232)(H,170,233)(H,171,231)(H,172,216)(H,173,219)(H,174,235)(H,175,225)(H,176,226)(H,177,227)(H,178,221)(H,179,218)(H,180,220)(H,181,222)(H,182,234)(H,183,236)(H,184,212)(H,185,224)(H,186,228)(H,187,237)(H,188,202)(H,189,229)(H,190,230)(H,203,204)(H,205,206)(H,207,208)(H,209,210)(H4,154,155,159)(H4,156,157,160)/t71-,72-,73+,74+,80-,82-,83-,84-,85-,86-,87-,88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,114-,115-,116-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.00190	n/a	n/a	n/a	n/a
Sanofi-Aventis Deutschland GmbH Curated by ChEMBL					Assay Description Agonist activity at human glucagon receptor expressed in HEK293 cells assessed as cAMP accumulation after 30 mins by HTRF assay				J Med Chem 60: 4293-4303 (2017) Article DOI: 10.1021/acs.jmedchem.7b00174 BindingDB Entry DOI: 10.7270/Q27S7R7M
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