Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 1522.7 BDBM50034118

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

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
Neuropeptide Y receptor type 2 (RAT)	BDBM50034118 (CHEMBL274850 | His-Tyr-Ile-Asn-Leu-Ile-Tyr-Arg-Leu...) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)Cc1cnc[nH]1)[C@@H](C)CC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O Show InChI InChI=1S/C73H111N21O15/c1-9-40(7)59(93-68(106)54(30-39(5)6)90-67(105)57(35-58(75)98)92-71(109)60(41(8)10-2)94-69(107)56(33-44-19-25-48(97)26-20-44)88-62(100)49(74)34-45-36-81-37-84-45)70(108)91-55(32-43-17-23-47(96)24-18-43)66(104)86-51(14-12-28-83-73(79)80)64(102)89-53(29-38(3)4)65(103)85-50(13-11-27-82-72(77)78)63(101)87-52(61(76)99)31-42-15-21-46(95)22-16-42/h15-26,36-41,49-57,59-60,95-97H,9-14,27-35,74H2,1-8H3,(H2,75,98)(H2,76,99)(H,81,84)(H,85,103)(H,86,104)(H,87,101)(H,88,100)(H,89,102)(H,90,105)(H,91,108)(H,92,109)(H,93,106)(H,94,107)(H4,77,78,82)(H4,79,80,83)/t40-,41-,49-,50-,51-,52-,53-,54-,55-,56-,57-,59-,60-/m0/s1	PDB Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
Burroughs Wellcome Company Curated by ChEMBL					Assay Description 50% displacement of specifically bound [3H]-NPY2 from rat brain membranes.				J Med Chem 38: 1150-7 (1995) BindingDB Entry DOI: 10.7270/Q2513X8D
					More data for this Ligand-Target Pair