BDBM50139917 Ac-(Glu-Ala-Asp-Lys)-Leu-Arg-Lys-Leu-Nle-Glu-Ile-Ile-NH2::CHEMBL411203

SMILES: CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)C(CCCCC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@@H](N(C)C(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(=O)N1)C(C)C)[C@@H](C)CC)C(N)=O

InChI Key: InChIKey=VBNOXRYTENILOC-DRLYSMOXSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50139917   

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
Corticotropin releasing factor receptor 1 (Homo sapiens (Human))	BDBM50139917 (Ac-(Glu-Ala-Asp-Lys)-Leu-Arg-Lys-Leu-Nle-Glu-Ile-I...) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)C(CCCCC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCCNC(=O)CC[C@@H](N(C)C(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(=O)N1)C(C)C)[C@@H](C)CC)C(N)=O Show InChI InChI=1S/C69H120N18O19/c1-12-38(7)56(58(72)96)85-68(106)57(39(8)13-2)86-64(102)46(26-29-54(92)93)78-60(98)42(37(5)6)21-14-15-25-51(89)47(33-36(3)4)82-62(100)43(22-16-18-30-70)79-61(99)45(24-20-32-76-69(73)74)81-65(103)48(34-52(71)90)84-63(101)44-23-17-19-31-75-53(91)28-27-50(87(11)41(10)88)67(105)77-40(9)59(97)83-49(35-55(94)95)66(104)80-44/h36-40,42-50,56-57H,12-35,70H2,1-11H3,(H2,71,90)(H2,72,96)(H,75,91)(H,77,105)(H,78,98)(H,79,99)(H,80,104)(H,81,103)(H,82,100)(H,83,97)(H,84,101)(H,85,106)(H,86,102)(H,92,93)(H,94,95)(H4,73,74,76)/t38-,39-,40-,42?,43-,44-,45-,46-,47-,48-,49-,50+,56-,57-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Central Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Binding affinity at human CRF1 receptor (CRFR1) on HeLA cell membranes.				J Med Chem 47: 1075-8 (2004) Article DOI: 10.1021/jm034180+ BindingDB Entry DOI: 10.7270/Q28P5ZXK
					More data for this Ligand-Target Pair