BDBM50395021 CHEMBL2163447::US9708370, 48 CP-2A(ii)

SMILES: C[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](CCCCN)C(N)=O

InChI Key: InChIKey=IQEVVNJZRDZSBT-QDTWMEOJSA-N

Data: 3 IC50

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 3 hits for monomerid = 50395021   

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
Ghrelin receptor (Homo sapiens (Human))	BDBM50395021 (CHEMBL2163447 | US9708370, 48 CP-2A(ii)) Show SMILES C[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](CCCCN)C(N)=O |r| Show InChI InChI=1S/C38H49N13O6/c1-21(34(53)47-30(33(41)52)12-6-7-13-39)46-36(55)31(14-22-17-43-28-10-4-2-8-25(22)28)49-38(57)51-50-37(56)32(15-23-18-44-29-11-5-3-9-26(23)29)48-35(54)27(40)16-24-19-42-20-45-24/h2-5,8-11,17-21,27,30-32,43-44H,6-7,12-16,39-40H2,1H3,(H2,41,52)(H,42,45)(H,46,55)(H,47,53)(H,48,54)(H,50,56)(H2,49,51,57)/t21-,27+,30+,31+,32-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Montr£al Curated by ChEMBL					Assay Description Displacement of [125I]ghrelin expressed in in LLC-PK1 cells incubated for 1 hr by gamma counting method				J Med Chem 55: 6502-11 (2012) Article DOI: 10.1021/jm300557t BindingDB Entry DOI: 10.7270/Q22J6D00
					More data for this Ligand-Target Pair
Ghrelin receptor (Homo sapiens (Human))	BDBM50395021 (CHEMBL2163447 | US9708370, 48 CP-2A(ii)) Show SMILES C[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](CCCCN)C(N)=O |r| Show InChI InChI=1S/C38H49N13O6/c1-21(34(53)47-30(33(41)52)12-6-7-13-39)46-36(55)31(14-22-17-43-28-10-4-2-8-25(22)28)49-38(57)51-50-37(56)32(15-23-18-44-29-11-5-3-9-26(23)29)48-35(54)27(40)16-24-19-42-20-45-24/h2-5,8-11,17-21,27,30-32,43-44H,6-7,12-16,39-40H2,1H3,(H2,41,52)(H,42,45)(H,46,55)(H,47,53)(H,48,54)(H,50,56)(H2,49,51,57)/t21-,27+,30+,31+,32-/m1/s1	PDB GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
VALORISATION-RECHERCHE, LIMITED PARTNERSHIP; VALORISATION HSJ, LIMITED PARTNERSHIP US Patent					Assay Description GHS-R1a radioreceptor assay using LLCPK-1 membranes overexpressing GSH-R1a and radioiodinated (1-28) rat ghrelin as tracer.				US Patent US9708370 (2017) BindingDB Entry DOI: 10.7270/Q2XP76ZK
					More data for this Ligand-Target Pair
Platelet glycoprotein 4 (Rattus norvegicus)	BDBM50395021 (CHEMBL2163447 | US9708370, 48 CP-2A(ii)) Show SMILES C[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](CCCCN)C(N)=O |r| Show InChI InChI=1S/C38H49N13O6/c1-21(34(53)47-30(33(41)52)12-6-7-13-39)46-36(55)31(14-22-17-43-28-10-4-2-8-25(22)28)49-38(57)51-50-37(56)32(15-23-18-44-29-11-5-3-9-26(23)29)48-35(54)27(40)16-24-19-42-20-45-24/h2-5,8-11,17-21,27,30-32,43-44H,6-7,12-16,39-40H2,1H3,(H2,41,52)(H,42,45)(H,46,55)(H,47,53)(H,48,54)(H,50,56)(H2,49,51,57)/t21-,27+,30+,31+,32-/m1/s1	PDB Reactome pathway UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Montr£al Curated by ChEMBL					Assay Description Displacement of photoactivatable [125I]-Tyr-Bpa-Ala-Hexarelin from CD36 in Sprague-Dawley rat cardiac membranes incubated for 60 mins by densitometry				J Med Chem 55: 6502-11 (2012) Article DOI: 10.1021/jm300557t BindingDB Entry DOI: 10.7270/Q22J6D00
					More data for this Ligand-Target Pair