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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Glucagon receptor' and Ligand = 'BDBM50534602'   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Glucagon receptor


(Homo sapiens (Human))		BDBM50534602
PNG
(CHEMBL4571762)
Show SMILES CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)[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(C)(C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccncc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)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(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H]([C@@H](C)O)C(O)=O |r|
Show InChI InChI=1S/C153H226N44O47S/c1-73(2)54-97(132(225)176-96(47-53-245-13)131(224)184-104(62-114(159)208)141(234)196-122(79(10)203)149(242)243)179-136(229)103(60-84-66-168-89-31-21-20-30-87(84)89)183-130(223)95(41-44-113(158)207)177-146(239)119(75(5)6)194-139(232)101(56-80-26-16-14-17-27-80)182-137(230)105(63-116(210)211)185-129(222)94(40-43-112(157)206)172-123(216)76(7)171-126(219)91(33-24-49-166-151(160)161)173-128(221)92(34-25-50-167-152(162)163)192-150(244)153(11,12)197-145(238)107(65-118(214)215)187-133(226)98(55-74(3)4)178-134(227)100(59-83-45-51-164-52-46-83)180-127(220)90(32-22-23-48-154)174-143(236)109(70-199)190-135(228)99(58-82-35-37-86(204)38-36-82)181-138(231)106(64-117(212)213)186-144(237)110(71-200)191-148(241)121(78(9)202)195-140(233)102(57-81-28-18-15-19-29-81)188-147(240)120(77(8)201)193-115(209)68-169-125(218)93(39-42-111(156)205)175-142(235)108(69-198)189-124(217)88(155)61-85-67-165-72-170-85/h14-21,26-31,35-38,45-46,51-52,66-67,72-79,88,90-110,119-122,168,198-204H,22-25,32-34,39-44,47-50,53-65,68-71,154-155H2,1-13H3,(H2,156,205)(H2,157,206)(H2,158,207)(H2,159,208)(H,165,170)(H,169,218)(H,171,219)(H,172,216)(H,173,221)(H,174,236)(H,175,235)(H,176,225)(H,177,239)(H,178,227)(H,179,229)(H,180,220)(H,181,231)(H,182,230)(H,183,223)(H,184,224)(H,185,222)(H,186,237)(H,187,226)(H,188,240)(H,189,217)(H,190,228)(H,191,241)(H,192,244)(H,193,209)(H,194,232)(H,195,233)(H,196,234)(H,197,238)(H,210,211)(H,212,213)(H,214,215)(H,242,243)(H4,160,161,166)(H4,162,163,167)/t76-,77+,78+,79+,88-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,108-,109-,110-,119-,120-,121-,122-/m0/s1
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 0.0340n/an/an/an/a



Indiana University

Curated by ChEMBL


Assay Description
Activation of glucagon receptor (unknown origin) transfected in HEK293 cells coinfected with luciferase reporter gene linked CRE element assessed as ...

J Med Chem 59: 8061-7 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00840
BindingDB Entry DOI: 10.7270/Q2BZ69H3
More data for this
Ligand-Target Pair