BDBM50369208 CHEMBL1794004

SMILES: CC[C@H](C)[C@H](NC(=O)[C@]12CC[C@H]([C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2)C(C)=C)C(O)=O

InChI Key: InChIKey=VVIYTKUUQHJMTQ-FXSKREIISA-N

Data: 2 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 2 hits for monomerid = 50369208   

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
Angiotensin-converting enzyme (Rattus norvegicus)	BDBM50369208 (CHEMBL1794004) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@]12CC[C@H]([C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2)C(C)=C)C(O)=O Show InChI InChI=1S/C36H59NO4/c1-10-22(4)29(30(39)40)37-31(41)36-18-13-23(21(2)3)28(36)24-11-12-26-33(7)16-15-27(38)32(5,6)25(33)14-17-35(26,9)34(24,8)19-20-36/h22-29,38H,2,10-20H2,1,3-9H3,(H,37,41)(H,39,40)/t22-,23-,24+,25-,26+,27-,28+,29-,33-,34+,35+,36-/m0/s1	KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.30	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Inhibitory activity against angiotensin I converting enzyme				J Med Chem 39: 1210-9 (1996) Article DOI: 10.1021/jm950590p BindingDB Entry DOI: 10.7270/Q2DF6RWV
					More data for this Ligand-Target Pair
Neprilysin (Oryctolagus cuniculus (rabbit))	BDBM50369208 (CHEMBL1794004) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@]12CC[C@H]([C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2)C(C)=C)C(O)=O Show InChI InChI=1S/C36H59NO4/c1-10-22(4)29(30(39)40)37-31(41)36-18-13-23(21(2)3)28(36)24-11-12-26-33(7)16-15-27(38)32(5,6)25(33)14-17-35(26,9)34(24,8)19-20-36/h22-29,38H,2,10-20H2,1,3-9H3,(H,37,41)(H,39,40)/t22-,23-,24+,25-,26+,27-,28+,29-,33-,34+,35+,36-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.5	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Inhibitory activity was tested against neutral endopeptidase				J Med Chem 39: 1210-9 (1996) Article DOI: 10.1021/jm950590p BindingDB Entry DOI: 10.7270/Q2DF6RWV
					More data for this Ligand-Target Pair