Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Growth hormone-releasing hormone receptor' and Ligand = 'BDBM50004993'   

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
Growth hormone-releasing hormone receptor (Rattus norvegicus)	BDBM50004993 (CHEMBL386366 | GRF-analogues) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)CC(=O)CCc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O Show InChI InChI=1S/C151H248N42O42S/c1-21-79(13)118(191-125(212)84(18)168-134(221)107(69-115(204)205)178-122(209)81(15)65-91(200)49-42-86-40-45-89(198)46-41-86)147(234)185-105(66-87-33-24-23-25-34-87)140(227)193-120(85(19)197)148(235)186-106(68-114(156)203)139(226)189-111(73-196)144(231)182-104(67-88-43-47-90(199)48-44-88)138(225)175-96(39-32-59-166-151(162)163)127(214)174-94(36-27-29-56-153)132(219)190-117(78(11)12)145(232)184-100(61-74(3)4)133(220)167-82(16)124(211)172-97(50-52-112(154)201)129(216)180-103(64-77(9)10)137(224)188-109(71-194)142(229)169-83(17)123(210)171-95(38-31-58-165-150(160)161)126(213)173-93(35-26-28-55-152)128(215)179-102(63-76(7)8)136(223)181-101(62-75(5)6)135(222)176-98(51-53-113(155)202)130(217)183-108(70-116(206)207)141(228)192-119(80(14)22-2)146(233)177-99(54-60-236-20)131(218)187-110(72-195)143(230)170-92(121(157)208)37-30-57-164-149(158)159/h23-25,33-34,40-41,43-48,74-85,92-111,117-120,194-199H,21-22,26-32,35-39,42,49-73,152-153H2,1-20H3,(H2,154,201)(H2,155,202)(H2,156,203)(H2,157,208)(H,167,220)(H,168,221)(H,169,229)(H,170,230)(H,171,210)(H,172,211)(H,173,213)(H,174,214)(H,175,225)(H,176,222)(H,177,233)(H,178,209)(H,179,215)(H,180,216)(H,181,223)(H,182,231)(H,183,217)(H,184,232)(H,185,234)(H,186,235)(H,187,218)(H,188,224)(H,189,226)(H,190,219)(H,191,212)(H,192,228)(H,193,227)(H,204,205)(H,206,207)(H4,158,159,164)(H4,160,161,165)(H4,162,163,166)/t79-,80-,81+,82-,83-,84-,85+,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,108-,109-,110-,111-,117-,118-,119-,120-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	0.730	n/a	n/a	n/a	n/a	n/a	n/a
Notre-Dame Hospital Research Curated by ChEMBL					Assay Description Compound was tested to Inhibit [125I]-Growth hormone-releasing factor in rat adenopituitary homogenates				J Med Chem 35: 1864-9 (1992) BindingDB Entry DOI: 10.7270/Q2Z0373P
					More data for this Ligand-Target Pair