null

SMILES: CCCCCCCCCCC(=O)OC[C@H](NC(=O)[C@H](CO)NC(=O)CN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCN=C(N)N)C(O)=O

InChI Key: InChIKey=GQDYTHQLLRWWTK-BQLOZDDLSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50422313   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Growth hormone secretagogue receptor type 1 (Homo sapiens (Human))	BDBM50422313 (CHEMBL2310891) Show SMILES CCCCCCCCCCC(=O)OC[C@H](NC(=O)[C@H](CO)NC(=O)CN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCN=C(N)N)C(O)=O |r,wU:181.185,226.232,188.193,57.59,70.71,40.40,107.109,160.162,145.147,125.127,214.218,18.20,197.201,230.235,wD:100.102,48.48,14.14,154.156,29.28,61.62,169.171,80.82,116.118,136.138,89.91,206.210,192.197,(60.62,-14.96,;59.09,-15.07,;58.22,-13.8,;56.69,-13.91,;55.82,-12.63,;54.29,-12.74,;53.42,-11.47,;51.89,-11.58,;51.02,-10.3,;49.49,-10.41,;48.63,-9.13,;49.3,-7.75,;47.09,-9.25,;46.23,-7.97,;44.69,-8.08,;44.02,-9.47,;44.88,-10.74,;46.42,-10.63,;44.21,-12.13,;42.67,-12.24,;41.81,-10.96,;45.07,-13.4,;44.4,-14.79,;42.86,-14.9,;45.26,-16.06,;44.59,-17.45,;43.83,-6.8,;44.5,-5.42,;42.29,-6.92,;41.43,-5.64,;42.1,-4.25,;41.24,-2.98,;41.91,-1.59,;41.05,-.32,;39.51,-.43,;38.84,-1.81,;39.7,-3.09,;39.89,-5.75,;39.22,-7.14,;39.03,-4.47,;37.49,-4.59,;36.82,-5.97,;35.28,-6.08,;34.61,-7.47,;34.42,-4.81,;36.63,-3.31,;37.3,-1.92,;35.09,-3.42,;34.23,-2.14,;34.9,-.76,;34.04,.52,;32.69,-2.26,;31.83,-.98,;32.02,-3.64,;32.75,-5,;31.68,-6.11,;30.29,-5.44,;30.5,-3.91,;29.39,-2.84,;29.76,-1.35,;27.91,-3.27,;26.8,-2.2,;27.17,-.71,;26.06,.36,;26.43,1.86,;27.91,2.28,;25.33,2.92,;25.33,-2.63,;24.96,-4.12,;24.22,-1.56,;22.74,-1.99,;22.37,-3.48,;20.89,-3.91,;20.36,-5.36,;18.82,-5.31,;18.4,-3.83,;19.67,-2.96,;21.63,-.92,;22,.57,;20.15,-1.35,;19.04,-.28,;19.41,1.21,;20.89,1.64,;21.26,3.14,;20.15,4.2,;22.74,3.56,;17.56,-.71,;17.19,-2.2,;16.45,.36,;14.97,-.07,;13.86,1,;14.23,2.5,;13.12,3.56,;13.49,5.06,;12.38,6.13,;12.75,7.62,;10.9,5.7,;14.6,-1.56,;15.71,-2.63,;13.12,-1.99,;12.01,-.92,;12.38,.57,;11.27,1.64,;13.32,1.79,;10.53,-1.35,;10.16,-2.84,;9.42,-.28,;7.94,-.71,;7.57,-2.2,;6.09,-2.63,;5.72,-4.12,;6.83,-5.19,;4.24,-4.55,;6.83,.36,;7.2,1.86,;5.35,-.07,;4.24,1,;4.61,2.5,;6.09,2.92,;6.46,4.42,;5.35,5.49,;7.94,4.85,;2.76,.57,;1.65,1.64,;2.39,-.92,;.91,-1.35,;.54,-2.84,;-.94,-3.27,;-1.31,-4.76,;-.2,-5.83,;-.57,-7.33,;.54,-8.4,;-2.05,-7.75,;-.2,-.28,;.17,1.21,;-1.68,-.71,;-2.79,.36,;-2.42,1.86,;-.94,2.28,;-.57,3.78,;.91,4.2,;1.28,5.7,;-4.27,-.07,;-4.64,-1.56,;-5.38,1,;-6.86,.57,;-7.23,-.92,;-8.71,-1.35,;-9.08,-2.84,;-7.97,-3.91,;-10.55,-3.27,;-7.97,1.64,;-7.6,3.14,;-9.45,1.21,;-10.55,2.28,;-10.18,3.78,;-11.29,4.85,;-12.03,1.86,;-12.4,.36,;-13.14,2.92,;-14.62,2.5,;-14.99,1,;-16.58,.02,;-13.43,.07,;-13.99,-.93,;-13.69,-2.24,;-15.73,3.56,;-15.36,5.06,;-16.94,2.48,;-18.63,1.86,;-19.61,1.49,;-20.17,2.28,;-21.65,1.86,;-22.76,2.92,;-24.24,2.5,;-18.26,.26,;-19.79,.15,;-17.39,-1.02,;-15.85,-1.07,;-15.43,-2.55,;-16.7,-3.41,;-18.06,-2.63,;-19.4,-2.89,;-20.41,-1.73,;-19.89,-4.35,;-19.01,-5.61,;-19.93,-6.84,;-21.39,-6.34,;-21.37,-4.8,;-22.6,-3.88,;-24.01,-4.48,;-22.41,-2.35,;-23.64,-1.43,;-23.46,.1,;-25.06,-2.03,;-25.25,-3.56,;-26.29,-1.11,;-27.71,-1.71,;-27.89,-3.24,;-26.66,-4.16,;-26.85,-5.69,;-25.62,-6.62,;-25.8,-8.15,;-28.94,-.79,;-28.76,.74,;-30.36,-1.39,;-31.59,-.47,;-31.4,1.06,;-32.64,1.99,;-34.05,1.38,;-32.45,3.52,;-33.01,-1.07,;-33.19,-2.6,;-34.24,-.15,;-35.65,-.75,;-35.84,-2.28,;-37.25,-2.88,;-37.44,-4.41,;-38.86,-5.02,;-36.21,-5.34,;-36.89,.17,;-36.7,1.7,;-38.3,-.43,;-38.65,-1.93,;-40.18,-2.07,;-40.78,-.65,;-39.62,.36,;-39.76,1.89,;-38.5,2.78,;-41.16,2.54,;-41.29,4.08,;-42.69,4.72,;-42.83,6.26,;-44.23,6.91,;-44.36,8.44,;-43.1,9.33,;-43.24,10.86,;-41.71,8.68,;-40.03,4.96,;-38.64,4.31,;-40.17,6.5,)| Show InChI InChI=1S/C152H255N47O42/c1-9-10-11-12-13-14-15-19-48-121(212)241-81-109(194-138(228)106(78-200)174-118(207)76-157)140(230)190-104(74-87-35-17-16-18-36-87)136(226)189-103(73-84(4)5)135(225)193-108(80-202)147(237)197-69-32-45-111(197)142(232)183-98(54-60-120(210)211)131(221)191-105(75-88-77-168-82-172-88)137(227)182-95(50-56-115(159)204)129(219)178-93(42-29-66-170-151(164)165)133(223)195-122(85(6)7)144(234)184-96(51-57-116(160)205)130(220)180-94(49-55-114(158)203)128(218)177-92(41-28-65-169-150(162)163)125(215)176-90(38-21-25-62-154)124(214)181-97(53-59-119(208)209)132(222)192-107(79-201)139(229)179-91(39-22-26-63-155)126(216)185-99(40-23-27-64-156)145(235)199-71-34-47-113(199)148(238)198-70-33-44-110(198)141(231)173-86(8)123(213)175-89(37-20-24-61-153)127(217)188-102(72-83(2)3)134(224)186-100(52-58-117(161)206)146(236)196-68-31-46-112(196)143(233)187-101(149(239)240)43-30-67-171-152(166)167/h16-18,35-36,77,82-86,89-113,122,200-202H,9-15,19-34,37-76,78-81,153-157H2,1-8H3,(H2,158,203)(H2,159,204)(H2,160,205)(H2,161,206)(H,168,172)(H,173,231)(H,174,207)(H,175,213)(H,176,215)(H,177,218)(H,178,219)(H,179,229)(H,180,220)(H,181,214)(H,182,227)(H,183,232)(H,184,234)(H,185,216)(H,186,224)(H,187,233)(H,188,217)(H,189,226)(H,190,230)(H,191,221)(H,192,222)(H,193,225)(H,194,228)(H,195,223)(H,208,209)(H,210,211)(H,239,240)(H4,162,163,169)(H4,164,165,170)(H4,166,167,171)/t86-,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,108-,109-,110-,111-,112-,113-,122-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	0.120	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to cloned human growth hormone secretagogue receptor type 1 in a competitive binding assay with [35S]-MK-0677 as a radiolabeled liga...				J Med Chem 43: 4370-6 (2000) BindingDB Entry DOI: 10.7270/Q2T72GP0
					More data for this Ligand-Target Pair