BDBM50395018 CHEMBL2163450::US9708370, 55 CP-2B(iv)

SMILES: CC(C)CN(NC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(N)=O

InChI Key: InChIKey=CBDNAEJWSKCRCH-QWOXOBPJSA-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 = 50395018   

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))	BDBM50395018 (CHEMBL2163450 | US9708370, 55 CP-2B(iv)) Show SMILES CC(C)CN(NC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(N)=O |r| Show InChI InChI=1S/C40H56N12O6/c1-24(2)22-52(51-36(54)25(3)47-37(55)30(42)19-28-21-44-23-46-28)40(58)50-34(18-27-20-45-31-14-8-7-13-29(27)31)39(57)49-33(17-26-11-5-4-6-12-26)38(56)48-32(35(43)53)15-9-10-16-41/h4-8,11-14,20-21,23-25,30,32-34,45H,9-10,15-19,22,41-42H2,1-3H3,(H2,43,53)(H,44,46)(H,47,55)(H,48,56)(H,49,57)(H,50,58)(H,51,54)/t25-,30+,32+,33-,34+/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))	BDBM50395018 (CHEMBL2163450 | US9708370, 55 CP-2B(iv)) Show SMILES CC(C)CN(NC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(N)=O |r| Show InChI InChI=1S/C40H56N12O6/c1-24(2)22-52(51-36(54)25(3)47-37(55)30(42)19-28-21-44-23-46-28)40(58)50-34(18-27-20-45-31-14-8-7-13-29(27)31)39(57)49-33(17-26-11-5-4-6-12-26)38(56)48-32(35(43)53)15-9-10-16-41/h4-8,11-14,20-21,23-25,30,32-34,45H,9-10,15-19,22,41-42H2,1-3H3,(H2,43,53)(H,44,46)(H,47,55)(H,48,56)(H,49,57)(H,50,58)(H,51,54)/t25-,30+,32+,33-,34+/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)	BDBM50395018 (CHEMBL2163450 | US9708370, 55 CP-2B(iv)) Show SMILES CC(C)CN(NC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(N)=O |r| Show InChI InChI=1S/C40H56N12O6/c1-24(2)22-52(51-36(54)25(3)47-37(55)30(42)19-28-21-44-23-46-28)40(58)50-34(18-27-20-45-31-14-8-7-13-29(27)31)39(57)49-33(17-26-11-5-4-6-12-26)38(56)48-32(35(43)53)15-9-10-16-41/h4-8,11-14,20-21,23-25,30,32-34,45H,9-10,15-19,22,41-42H2,1-3H3,(H2,43,53)(H,44,46)(H,47,55)(H,48,56)(H,49,57)(H,50,58)(H,51,54)/t25-,30+,32+,33-,34+/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