Found 3 hits Enz. Inhib. hit(s) with Target = 'Glucagon-like peptide 1 receptor' and Ligand = 'BDBM50121531' 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-like peptide 1 receptor
(Homo sapiens (Human)) | BDBM50121531
(CHEMBL3616741)Show SMILES CCCCCCCCCCCCCCCC(=O)N[C@@H](CCC(=O)NCCOCCOCC(=O)NCCCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](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(O)=O)NC(=O)C(C)(C)NC(=O)[C@@H](N)Cc1c[nH]cn1)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(O)=O)C(O)=O |r| Show InChI InChI=1S/C179H278N44O54/c1-19-21-22-23-24-25-26-27-28-29-30-31-38-54-134(232)202-121(175(273)274)60-65-133(231)188-72-73-276-74-75-277-93-138(236)187-69-42-41-51-116(158(256)205-120(63-68-141(241)242)159(257)210-125(78-105-45-34-32-35-46-105)164(262)221-146(99(11)20-2)172(270)199-102(14)151(249)207-127(81-108-84-191-113-50-40-39-49-111(108)113)162(260)209-123(77-96(5)6)163(261)219-144(97(7)8)170(268)206-115(53-44-71-190-178(184)185)154(252)192-86-135(233)200-114(52-43-70-189-177(182)183)153(251)195-89-143(245)246)203-150(248)101(13)197-149(247)100(12)198-157(255)119(59-64-132(181)230)201-136(234)87-193-155(253)117(61-66-139(237)238)204-160(258)122(76-95(3)4)208-161(259)124(80-107-55-57-110(229)58-56-107)211-167(265)129(90-224)214-169(267)131(92-226)215-171(269)145(98(9)10)220-166(264)128(83-142(243)244)212-168(266)130(91-225)216-174(272)148(104(16)228)222-165(263)126(79-106-47-36-33-37-48-106)213-173(271)147(103(15)227)218-137(235)88-194-156(254)118(62-67-140(239)240)217-176(275)179(17,18)223-152(250)112(180)82-109-85-186-94-196-109/h32-37,39-40,45-50,55-58,84-85,94-104,112,114-131,144-148,191,224-229H,19-31,38,41-44,51-54,59-83,86-93,180H2,1-18H3,(H2,181,230)(H,186,196)(H,187,236)(H,188,231)(H,192,252)(H,193,253)(H,194,254)(H,195,251)(H,197,247)(H,198,255)(H,199,270)(H,200,233)(H,201,234)(H,202,232)(H,203,248)(H,204,258)(H,205,256)(H,206,268)(H,207,249)(H,208,259)(H,209,260)(H,210,257)(H,211,265)(H,212,266)(H,213,271)(H,214,267)(H,215,269)(H,216,272)(H,217,275)(H,218,235)(H,219,261)(H,220,264)(H,221,262)(H,222,263)(H,223,250)(H,237,238)(H,239,240)(H,241,242)(H,243,244)(H,245,246)(H,273,274)(H4,182,183,189)(H4,184,185,190)/t99-,100-,101-,102-,103+,104+,112-,114-,115-,116-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,144-,145-,146-,147-,148-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.160 | n/a | n/a | n/a | n/a | n/a | n/a |
Novo Nordisk A/S
Curated by ChEMBL
| Assay Description
Displacement of [125I]-GLP1 from human GLP1 receptor expressed in BHK cells after 2 hrs in absence of human serum albumin |
J Med Chem 58: 7370-80 (2015)
Article DOI: 10.1021/acs.jmedchem.5b00726
BindingDB Entry DOI: 10.7270/Q2TX3H6D |
More data for this
Ligand-Target Pair | |
Glucagon-like peptide 1 receptor
(Homo sapiens (Human)) | BDBM50121531
(CHEMBL3616741)Show SMILES CCCCCCCCCCCCCCCC(=O)N[C@@H](CCC(=O)NCCOCCOCC(=O)NCCCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](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(O)=O)NC(=O)C(C)(C)NC(=O)[C@@H](N)Cc1c[nH]cn1)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(O)=O)C(O)=O |r| Show InChI InChI=1S/C179H278N44O54/c1-19-21-22-23-24-25-26-27-28-29-30-31-38-54-134(232)202-121(175(273)274)60-65-133(231)188-72-73-276-74-75-277-93-138(236)187-69-42-41-51-116(158(256)205-120(63-68-141(241)242)159(257)210-125(78-105-45-34-32-35-46-105)164(262)221-146(99(11)20-2)172(270)199-102(14)151(249)207-127(81-108-84-191-113-50-40-39-49-111(108)113)162(260)209-123(77-96(5)6)163(261)219-144(97(7)8)170(268)206-115(53-44-71-190-178(184)185)154(252)192-86-135(233)200-114(52-43-70-189-177(182)183)153(251)195-89-143(245)246)203-150(248)101(13)197-149(247)100(12)198-157(255)119(59-64-132(181)230)201-136(234)87-193-155(253)117(61-66-139(237)238)204-160(258)122(76-95(3)4)208-161(259)124(80-107-55-57-110(229)58-56-107)211-167(265)129(90-224)214-169(267)131(92-226)215-171(269)145(98(9)10)220-166(264)128(83-142(243)244)212-168(266)130(91-225)216-174(272)148(104(16)228)222-165(263)126(79-106-47-36-33-37-48-106)213-173(271)147(103(15)227)218-137(235)88-194-156(254)118(62-67-140(239)240)217-176(275)179(17,18)223-152(250)112(180)82-109-85-186-94-196-109/h32-37,39-40,45-50,55-58,84-85,94-104,112,114-131,144-148,191,224-229H,19-31,38,41-44,51-54,59-83,86-93,180H2,1-18H3,(H2,181,230)(H,186,196)(H,187,236)(H,188,231)(H,192,252)(H,193,253)(H,194,254)(H,195,251)(H,197,247)(H,198,255)(H,199,270)(H,200,233)(H,201,234)(H,202,232)(H,203,248)(H,204,258)(H,205,256)(H,206,268)(H,207,249)(H,208,259)(H,209,260)(H,210,257)(H,211,265)(H,212,266)(H,213,271)(H,214,267)(H,215,269)(H,216,272)(H,217,275)(H,218,235)(H,219,261)(H,220,264)(H,221,262)(H,222,263)(H,223,250)(H,237,238)(H,239,240)(H,241,242)(H,243,244)(H,245,246)(H,273,274)(H4,182,183,189)(H4,184,185,190)/t99-,100-,101-,102-,103+,104+,112-,114-,115-,116-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,144-,145-,146-,147-,148-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.40 | n/a | n/a | n/a | n/a | n/a | n/a |
Novo Nordisk A/S
Curated by ChEMBL
| Assay Description
Displacement of [125I]-GLP1 from human GLP1 receptor expressed in BHK cells after 2 hrs in presence of 2% human serum albumin |
J Med Chem 58: 7370-80 (2015)
Article DOI: 10.1021/acs.jmedchem.5b00726
BindingDB Entry DOI: 10.7270/Q2TX3H6D |
More data for this
Ligand-Target Pair | |
Glucagon-like peptide 1 receptor
(Homo sapiens (Human)) | BDBM50121531
(CHEMBL3616741)Show SMILES CCCCCCCCCCCCCCCC(=O)N[C@@H](CCC(=O)NCCOCCOCC(=O)NCCCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](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(O)=O)NC(=O)C(C)(C)NC(=O)[C@@H](N)Cc1c[nH]cn1)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(O)=O)C(O)=O |r| Show InChI InChI=1S/C179H278N44O54/c1-19-21-22-23-24-25-26-27-28-29-30-31-38-54-134(232)202-121(175(273)274)60-65-133(231)188-72-73-276-74-75-277-93-138(236)187-69-42-41-51-116(158(256)205-120(63-68-141(241)242)159(257)210-125(78-105-45-34-32-35-46-105)164(262)221-146(99(11)20-2)172(270)199-102(14)151(249)207-127(81-108-84-191-113-50-40-39-49-111(108)113)162(260)209-123(77-96(5)6)163(261)219-144(97(7)8)170(268)206-115(53-44-71-190-178(184)185)154(252)192-86-135(233)200-114(52-43-70-189-177(182)183)153(251)195-89-143(245)246)203-150(248)101(13)197-149(247)100(12)198-157(255)119(59-64-132(181)230)201-136(234)87-193-155(253)117(61-66-139(237)238)204-160(258)122(76-95(3)4)208-161(259)124(80-107-55-57-110(229)58-56-107)211-167(265)129(90-224)214-169(267)131(92-226)215-171(269)145(98(9)10)220-166(264)128(83-142(243)244)212-168(266)130(91-225)216-174(272)148(104(16)228)222-165(263)126(79-106-47-36-33-37-48-106)213-173(271)147(103(15)227)218-137(235)88-194-156(254)118(62-67-140(239)240)217-176(275)179(17,18)223-152(250)112(180)82-109-85-186-94-196-109/h32-37,39-40,45-50,55-58,84-85,94-104,112,114-131,144-148,191,224-229H,19-31,38,41-44,51-54,59-83,86-93,180H2,1-18H3,(H2,181,230)(H,186,196)(H,187,236)(H,188,231)(H,192,252)(H,193,253)(H,194,254)(H,195,251)(H,197,247)(H,198,255)(H,199,270)(H,200,233)(H,201,234)(H,202,232)(H,203,248)(H,204,258)(H,205,256)(H,206,268)(H,207,249)(H,208,259)(H,209,260)(H,210,257)(H,211,265)(H,212,266)(H,213,271)(H,214,267)(H,215,269)(H,216,272)(H,217,275)(H,218,235)(H,219,261)(H,220,264)(H,221,262)(H,222,263)(H,223,250)(H,237,238)(H,239,240)(H,241,242)(H,243,244)(H,245,246)(H,273,274)(H4,182,183,189)(H4,184,185,190)/t99-,100-,101-,102-,103+,104+,112-,114-,115-,116-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,144-,145-,146-,147-,148-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 0.0150 | n/a | n/a | n/a | n/a |
Novo Nordisk A/S
Curated by ChEMBL
| Assay Description
Agonist activity at human GLP1 receptor expressed in BHK cells after 3 hrs by CRE firefly luciferase reporter gene assay in absence of human serum al... |
J Med Chem 58: 7370-80 (2015)
Article DOI: 10.1021/acs.jmedchem.5b00726
BindingDB Entry DOI: 10.7270/Q2TX3H6D |
More data for this
Ligand-Target Pair | |
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