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SMILES: CCc1ccc(NC(=O)CCn2nc(C)c(c2C)S(=O)(=O)N2CCCCC2)cc1

InChI Key: InChIKey=NGONKFPFIUJJKV-UHFFFAOYSA-N

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 = 83818   
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
Neuropilin-1


(Homo sapiens (Human))
BDBM83818
PNG
(3-(3,5-dimethyl-4-piperidin-1-ylsulfonyl-pyrazol-1...)
Show SMILES CCc1ccc(NC(=O)CCn2nc(C)c(c2C)S(=O)(=O)N2CCCCC2)cc1
Show InChI InChI=1S/C21H30N4O3S/c1-4-18-8-10-19(11-9-18)22-20(26)12-15-25-17(3)21(16(2)23-25)29(27,28)24-13-6-5-7-14-24/h8-11H,4-7,12-15H2,1-3H3,(H,22,26)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a>9.50E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2HM5725
More data for this
Ligand-Target Pair
Orotidine 5'-phosphate decarboxylase


(Aspergillus niger)
BDBM83818
PNG
(3-(3,5-dimethyl-4-piperidin-1-ylsulfonyl-pyrazol-1...)
Show SMILES CCc1ccc(NC(=O)CCn2nc(C)c(c2C)S(=O)(=O)N2CCCCC2)cc1
Show InChI InChI=1S/C21H30N4O3S/c1-4-18-8-10-19(11-9-18)22-20(26)12-15-25-17(3)21(16(2)23-25)29(27,28)24-13-6-5-7-14-24/h8-11H,4-7,12-15H2,1-3H3,(H,22,26)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a>5.97E+4n/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRISMC) Center Affiliation: The Scripps Research Institute, TS...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2PK0DN5
More data for this
Ligand-Target Pair