BindingDB logo
myBDB logout

BDBM56841 4-[2-[[2-[(3-methyl-1,3-benzothiazol-2-ylidene)amino]-2-oxoethyl]thio]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester::4-[2-[[2-keto-2-[(3-methyl-1,3-benzothiazol-2-ylidene)amino]ethyl]thio]acetyl]piperazine-1-carboxylic acid ethyl ester::MLS000091398::SMR000025954::cid_3237774::ethyl 4-[2-[2-[(3-methyl-1,3-benzothiazol-2-ylidene)amino]-2-oxidanylidene-ethyl]sulfanylethanoyl]piperazine-1-carboxylate::ethyl 4-[2-[2-[(3-methyl-1,3-benzothiazol-2-ylidene)amino]-2-oxoethyl]sulfanylacetyl]piperazine-1-carboxylate::ethyl 4-{[(2-{[(2Z)-3-methyl-1,3-benzothiazol-2(3H)-ylidene]amino}-2-oxoethyl)thio]acetyl}piperazine-1-carboxylate

SMILES: CCOC(=O)N1CCN(CC1)C(=O)CSCC(=O)N=c1sc2ccccc2n1C

InChI Key: InChIKey=IPPICVQUJGDJOR-UHFFFAOYSA-N

Data: 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 1 hit for monomerid = 56841   
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
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM56841
PNG
(4-[2-[[2-[(3-methyl-1,3-benzothiazol-2-ylidene)ami...)
Show SMILES CCOC(=O)N1CCN(CC1)C(=O)CSCC(=O)N=c1sc2ccccc2n1C |w:18.18|
Show InChI InChI=1S/C19H24N4O4S2/c1-3-27-19(26)23-10-8-22(9-11-23)17(25)13-28-12-16(24)20-18-21(2)14-6-4-5-7-15(14)29-18/h4-7H,3,8-13H2,1-2H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 4.25E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Project Title: A screen for modulators of human Rad51, a key DNA repair protein Application Number: MH084119 Assay Submitter: Dr. Alex Mazin Submitte...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2BV7F1T
More data for this
Ligand-Target Pair