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BDBM95861 2-[(3R,4S)-1-benzyl-4-(4-bromophenyl)-2-keto-pyrrolidin-3-yl]-N-(4-bromophenyl)acetamide::2-[(3R,4S)-1-benzyl-4-(4-bromophenyl)-2-oxopyrrolidin-3-yl]-N-(4-bromophenyl)acetamide::KUC104803::MLS003116282::N-(4-bromophenyl)-2-[(3R,4S)-4-(4-bromophenyl)-2-oxidanylidene-1-(phenylmethyl)pyrrolidin-3-yl]ethanamide::N-(4-bromophenyl)-2-[(3R,4S)-4-(4-bromophenyl)-2-oxo-1-(phenylmethyl)-3-pyrrolidinyl]acetamide::SMR001831835::cid_46903037

SMILES: Brc1ccc(NC(=O)C[C@@H]2[C@H](CN(Cc3ccccc3)C2=O)c2ccc(Br)cc2)cc1

InChI Key: InChIKey=YBIWTMVZCVVRMG-DHIUTWEWSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 95861   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Methionine--tRNA ligase


(Trypanosoma brucei brucei strain 927/4 GUTat10.1)
BDBM95861
PNG
(2-[(3R,4S)-1-benzyl-4-(4-bromophenyl)-2-keto-pyrro...)
Show SMILES Brc1ccc(NC(=O)C[C@@H]2[C@H](CN(Cc3ccccc3)C2=O)c2ccc(Br)cc2)cc1
Show InChI InChI=1S/C25H22Br2N2O2/c26-19-8-6-18(7-9-19)23-16-29(15-17-4-2-1-3-5-17)25(31)22(23)14-24(30)28-21-12-10-20(27)11-13-21/h1-13,22-23H,14-16H2,(H,28,30)/t22-,23-/m1/s1
PDB

KEGG

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a 1.78E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q2XP73JZ
More data for this
Ligand-Target Pair