Compile Data Set for Download or QSAR
Found 1 Enz. Inhib. hit(s) with Target = 'Glucagon-like peptide 1 receptor' and Ligand = 'BDBM50314038'
TargetGlucagon-like peptide 1 receptor(Rattus norvegicus)
Sungkyunkwan University

Curated by ChEMBL
LigandPNGBDBM50314038(CHEMBL1092705)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCNC(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)OC(=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(O)=O)NC(=O)CNC(=O)[C@@H](N)Cc1cnc[nH]1)[C@@H](C)O)[C@@H](C)O)C(C)C)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](CCCCNC(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C)C(=O)N[C@@H](CC(N)=O)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](CO)C(N)=O
Show InChI InChI=1S/C232H357N49O69S/c1-22-118(10)191(221(343)261-150(64-72-186(312)313)207(329)265-156(91-127-101-243-141-45-30-29-44-133(127)141)211(333)263-152(86-114(2)3)209(331)253-143(47-32-34-79-241-176(298)67-54-120(12)135-56-58-137-189-139(98-172(294)232(135,137)20)230(18)77-74-132(290)93-129(230)95-169(189)292)202(324)266-157(99-174(235)296)198(320)246-103-177(299)244-107-181(303)278-81-36-49-164(278)217(339)271-161(110-284)216(338)270-160(109-283)199(321)248-104-178(300)250-122(14)224(346)280-83-38-51-166(280)226(348)281-84-39-52-167(281)225(347)279-82-37-50-165(279)218(340)269-159(108-282)194(236)316)276-212(334)154(89-125-40-25-23-26-41-125)264-210(332)153(87-115(4)5)262-203(325)144(48-35-80-242-228(237)238)260-220(342)190(117(8)9)275-195(317)121(13)251-200(322)147(61-69-183(306)307)256-205(327)148(62-70-184(308)309)257-206(328)149(63-71-185(310)311)258-208(330)151(75-85-351-21)259-204(326)146(59-65-173(234)295)255-201(323)142(46-31-33-78-240-175(297)66-53-119(11)134-55-57-136-188-138(97-171(293)231(134,136)19)229(17)76-73-131(289)92-128(229)94-168(188)291)254-214(336)162(111-285)272-219(341)170(88-116(6)7)350-227(349)158(100-187(314)315)268-215(337)163(112-286)273-223(345)193(124(16)288)277-213(335)155(90-126-42-27-24-28-43-126)267-222(344)192(123(15)287)274-180(302)106-247-197(319)145(60-68-182(304)305)252-179(301)105-245-196(318)140(233)96-130-102-239-113-249-130/h23-30,40-45,101-102,113-124,128-129,131-132,134-140,142-172,188-193,243,282-294H,22,31-39,46-100,103-112,233H2,1-21H3,(H2,234,295)(H2,235,296)(H2,236,316)(H,239,249)(H,240,297)(H,241,298)(H,244,299)(H,245,318)(H,246,320)(H,247,319)(H,248,321)(H,250,300)(H,251,322)(H,252,301)(H,253,331)(H,254,336)(H,255,323)(H,256,327)(H,257,328)(H,258,330)(H,259,326)(H,260,342)(H,261,343)(H,262,325)(H,263,333)(H,264,332)(H,265,329)(H,266,324)(H,267,344)(H,268,337)(H,269,340)(H,270,338)(H,271,339)(H,272,341)(H,273,345)(H,274,302)(H,275,317)(H,276,334)(H,277,335)(H,304,305)(H,306,307)(H,308,309)(H,310,311)(H,312,313)(H,314,315)(H4,237,238,242)/t118-,119+,120+,121-,122-,123+,124+,128-,129-,131+,132+,134+,135+,136-,137-,138-,139-,140-,142-,143-,144-,145-,146-,147-,148-,149-,150-,151-,152-,153-,154-,155-,156-,157-,158-,159-,160-,161-,162-,163-,164-,165-,166-,167-,168+,169+,170-,171-,172-,188-,189-,190-,191-,192-,193-,229-,230-,231+,232+/m0/s1
Affinity DataIC50: 3.18nMAssay Description:Displacement of [125I]exendin-4 from GLP1 receptor in rat RINm5F cells after 2 hrs by gamma countingMore data for this Ligand-Target Pair