BDBM50395015 CHEMBL2163453::US9708370, CP-2B(i)

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

InChI Key: InChIKey=WUBJNGRVHRATEF-DPJXOFTMSA-N

Data: 4 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 4 hits for monomerid = 50395015   

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
Growth hormone secretagogue receptor type 1 (Homo sapiens (Human))	BDBM50395015 (CHEMBL2163453 | US9708370, CP-2B(i)) Show SMILES CC(C)CN(NC(=O)[C@@H](Cc1c[nH]c2ccccc12)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](C)C(N)=O |r| Show InChI InChI=1S/C45H54N12O6/c1-26(2)24-57(56-44(62)39(19-30-22-50-36-16-10-8-14-33(30)36)53-41(59)34(46)20-31-23-48-25-51-31)45(63)55-38(18-29-21-49-35-15-9-7-13-32(29)35)43(61)54-37(17-28-11-5-4-6-12-28)42(60)52-27(3)40(47)58/h4-16,21-23,25-27,34,37-39,49-50H,17-20,24,46H2,1-3H3,(H2,47,58)(H,48,51)(H,52,60)(H,53,59)(H,54,61)(H,55,63)(H,56,62)/t27-,34-,37+,38-,39+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.17E+3	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
Platelet glycoprotein 4 (Rattus norvegicus)	BDBM50395015 (CHEMBL2163453 | US9708370, CP-2B(i)) Show SMILES CC(C)CN(NC(=O)[C@@H](Cc1c[nH]c2ccccc12)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](C)C(N)=O |r| Show InChI InChI=1S/C45H54N12O6/c1-26(2)24-57(56-44(62)39(19-30-22-50-36-16-10-8-14-33(30)36)53-41(59)34(46)20-31-23-48-25-51-31)45(63)55-38(18-29-21-49-35-15-9-7-13-32(29)35)43(61)54-37(17-28-11-5-4-6-12-28)42(60)52-27(3)40(47)58/h4-16,21-23,25-27,34,37-39,49-50H,17-20,24,46H2,1-3H3,(H2,47,58)(H,48,51)(H,52,60)(H,53,59)(H,54,61)(H,55,63)(H,56,62)/t27-,34-,37+,38-,39+/m0/s1	PDB Reactome pathway UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	9.02E+3	n/a	n/a	n/a	n/a	7.3	n/a
VALORISATION-RECHERCHE, LIMITED PARTNERSHIP; VALORISATION HSJ, LIMITED PARTNERSHIP US Patent					Assay Description Competition experiments were performed by incubating 50 μg of LLC-PK1 membranes expressing human GHS-R1a with 15 fmol of 125I-Ghrelin and increa...				US Patent US9708370 (2017) BindingDB Entry DOI: 10.7270/Q2XP76ZK
					More data for this Ligand-Target Pair
Estrogen receptor [D538G] (Homo sapiens (Human))	BDBM50395015 (CHEMBL2163453 | US9708370, CP-2B(i)) Show SMILES CC(C)CN(NC(=O)[C@@H](Cc1c[nH]c2ccccc12)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](C)C(N)=O |r| Show InChI InChI=1S/C45H54N12O6/c1-26(2)24-57(56-44(62)39(19-30-22-50-36-16-10-8-14-33(30)36)53-41(59)34(46)20-31-23-48-25-51-31)45(63)55-38(18-29-21-49-35-15-9-7-13-32(29)35)43(61)54-37(17-28-11-5-4-6-12-28)42(60)52-27(3)40(47)58/h4-16,21-23,25-27,34,37-39,49-50H,17-20,24,46H2,1-3H3,(H2,47,58)(H,48,51)(H,52,60)(H,53,59)(H,54,61)(H,55,63)(H,56,62)/t27-,34-,37+,38-,39+/m0/s1	PDB GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	8.17E+3	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)	BDBM50395015 (CHEMBL2163453 | US9708370, CP-2B(i)) Show SMILES CC(C)CN(NC(=O)[C@@H](Cc1c[nH]c2ccccc12)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](C)C(N)=O |r| Show InChI InChI=1S/C45H54N12O6/c1-26(2)24-57(56-44(62)39(19-30-22-50-36-16-10-8-14-33(30)36)53-41(59)34(46)20-31-23-48-25-51-31)45(63)55-38(18-29-21-49-35-15-9-7-13-32(29)35)43(61)54-37(17-28-11-5-4-6-12-28)42(60)52-27(3)40(47)58/h4-16,21-23,25-27,34,37-39,49-50H,17-20,24,46H2,1-3H3,(H2,47,58)(H,48,51)(H,52,60)(H,53,59)(H,54,61)(H,55,63)(H,56,62)/t27-,34-,37+,38-,39+/m0/s1	PDB Reactome pathway UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.59E+3	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