BDBM50180869 CHEMBL3819001

SMILES: CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C(=O)c1c([nH]c2ccccc12)-c1ccccc1)C(=O)NC

InChI Key: InChIKey=NUROBXGZWIJWJT-OICBGKIFSA-N

Data: 1 KI  1 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 = 50180869   

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
Peripheral-Type Benzodiazepine Receptor (Rattus norvegicus (rat))	BDBM50180869 (CHEMBL3819001) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C(=O)c1c([nH]c2ccccc12)-c1ccccc1)C(=O)NC |r| Show InChI InChI=1S/C32H34N4O4/c1-4-20(2)27(31(39)33-3)36-30(38)25(19-21-13-7-5-8-14-21)35-32(40)29(37)26-23-17-11-12-18-24(23)34-28(26)22-15-9-6-10-16-22/h5-18,20,25,27,34H,4,19H2,1-3H3,(H,33,39)(H,35,40)(H,36,38)/t20-,25-,27-/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	504	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Pisa Curated by ChEMBL					Assay Description Displacement of [3H]PK11195 from TSPO in rat kidney mitochondrial membrane after 90 mins by liquid scintillation counting method				J Med Chem 59: 4526-38 (2016) BindingDB Entry DOI: 10.7270/Q2NV9M6P
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM50180869 (CHEMBL3819001) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C(=O)c1c([nH]c2ccccc12)-c1ccccc1)C(=O)NC |r| Show InChI InChI=1S/C32H34N4O4/c1-4-20(2)27(31(39)33-3)36-30(38)25(19-21-13-7-5-8-14-21)35-32(40)29(37)26-23-17-11-12-18-24(23)34-28(26)22-15-9-6-10-16-22/h5-18,20,25,27,34H,4,19H2,1-3H3,(H,33,39)(H,35,40)(H,36,38)/t20-,25-,27-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	9.80	n/a	n/a	n/a	n/a	n/a	n/a
University of Pisa Curated by ChEMBL					Assay Description Binding affinity to MDM2 in human U87MG cells assessed as inhibition of MDM2/p53 protein interaction after 10 mins by quantitative sandwich immuno as...				J Med Chem 59: 4526-38 (2016) BindingDB Entry DOI: 10.7270/Q2NV9M6P
					More data for this Ligand-Target Pair