BDBM50163561 CHEMBL3792511

SMILES: [H][C@@]12C[C@@]([H])(C1(C)C)[C@]1(C)OB(OC1C2)[C@H](CCCC)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CCCc2ccccc12

InChI Key: InChIKey=OLLXHMPFWVGDOS-XWRXRWDISA-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 = 50163561   

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))	BDBM50163561 (CHEMBL3792511) Show SMILES [H][C@@]12C[C@@]([H])(C1(C)C)[C@]1(C)OB(OC1C2)[C@H](CCCC)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CCCc2ccccc12 |r| Show InChI InChI=1S/C35H47BN2O4/c1-5-6-19-31(36-41-30-22-25-21-29(34(25,2)3)35(30,4)42-36)38-33(40)28(20-23-13-8-7-9-14-23)37-32(39)27-18-12-16-24-15-10-11-17-26(24)27/h7-11,13-15,17,25,27-31H,5-6,12,16,18-22H2,1-4H3,(H,37,39)(H,38,40)/t25-,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	5.25E+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))	BDBM50163561 (CHEMBL3792511) Show SMILES [H][C@@]12C[C@@]([H])(C1(C)C)[C@]1(C)OB(OC1C2)[C@H](CCCC)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CCCc2ccccc12 |r| Show InChI InChI=1S/C35H47BN2O4/c1-5-6-19-31(36-41-30-22-25-21-29(34(25,2)3)35(30,4)42-36)38-33(40)28(20-23-13-8-7-9-14-23)37-32(39)27-18-12-16-24-15-10-11-17-26(24)27/h7-11,13-15,17,25,27-31H,5-6,12,16,18-22H2,1-4H3,(H,37,39)(H,38,40)/t25-,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	1.90	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