Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 1369.6 BDBM50034113

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)	BDBM50034113 (CHEMBL385246 | Tyr-Ile-Asn-Pro-Ile-Tyr-Arg-Leu-Arg...) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H]([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/C66H100N18O14/c1-7-36(5)53(82-56(90)44(67)31-38-15-21-41(85)22-16-38)63(97)81-50(34-52(68)88)64(98)84-29-11-14-51(84)61(95)83-54(37(6)8-2)62(96)80-49(33-40-19-25-43(87)26-20-40)60(94)77-46(13-10-28-75-66(72)73)58(92)79-48(30-35(3)4)59(93)76-45(12-9-27-74-65(70)71)57(91)78-47(55(69)89)32-39-17-23-42(86)24-18-39/h15-26,35-37,44-51,53-54,85-87H,7-14,27-34,67H2,1-6H3,(H2,68,88)(H2,69,89)(H,76,93)(H,77,94)(H,78,91)(H,79,92)(H,80,96)(H,81,97)(H,82,90)(H,83,95)(H4,70,71,74)(H4,72,73,75)/t36-,37-,44-,45-,46-,47-,48-,49-,50-,51-,53-,54-/m0/s1	PDB Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	44	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
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