BDBM50163668 CHEMBL3793242

SMILES: [H][C@@]12C[C@@]([H])(C1(C)C)[C@]1(C)OB(OC1C2)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)C1CCc2ccccc2C1

InChI Key: InChIKey=GYYYOHZOHGQJAU-LSKFSIAJSA-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 = 50163668   

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
20S proteasome chymotrypsin-like (Homo sapiens (Human))	BDBM50163668 (CHEMBL3793242) Show SMILES [H][C@@]12C[C@@]([H])(C1(C)C)[C@]1(C)OB(OC1C2)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)C1CCc2ccccc2C1 |r| Show InChI InChI=1S/C35H47BN2O4/c1-22(2)17-31(36-41-30-21-27-20-29(34(27,3)4)35(30,5)42-36)38-33(40)28(18-23-11-7-6-8-12-23)37-32(39)26-16-15-24-13-9-10-14-25(24)19-26/h6-14,22,26-31H,15-21H2,1-5H3,(H,37,39)(H,38,40)/t26?,27-,28-,29-,30?,31-,35-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	6.92E+8	n/a	n/a	n/a	n/a	n/a	n/a
Nanjing Forestry University Curated by ChEMBL					Assay Description Inhibition of chymotrypsin like activity of human 20S proteasome using Suc-Leu-Leu-Val-Tyr-AMC as substrate preincubated for 10 mins followed by subs...				Bioorg Med Chem 24: 2576-88 (2016) BindingDB Entry DOI: 10.7270/Q2P84DSC
					More data for this Ligand-Target Pair
20S proteasome chymotrypsin-like (Homo sapiens (Human))	BDBM50163668 (CHEMBL3793242) Show SMILES [H][C@@]12C[C@@]([H])(C1(C)C)[C@]1(C)OB(OC1C2)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)C1CCc2ccccc2C1 |r| Show InChI InChI=1S/C35H47BN2O4/c1-22(2)17-31(36-41-30-21-27-20-29(34(27,3)4)35(30,5)42-36)38-33(40)28(18-23-11-7-6-8-12-23)37-32(39)26-16-15-24-13-9-10-14-25(24)19-26/h6-14,22,26-31H,15-21H2,1-5H3,(H,37,39)(H,38,40)/t26?,27-,28-,29-,30?,31-,35-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.5	n/a	n/a	n/a	n/a	n/a	n/a
Nanjing Forestry University Curated by ChEMBL					Assay Description Inhibition of chymotrypsin like activity of human 20S proteasome using Suc-Leu-Leu-Val-Tyr-AMC as substrate preincubated for 10 mins followed by subs...				Bioorg Med Chem 24: 2576-88 (2016) BindingDB Entry DOI: 10.7270/Q2P84DSC
					More data for this Ligand-Target Pair