BDBM62338 MLS-0425704.0001::N-[1-(2-fluorophenyl)-4,5,6,7-tetrahydroindazol-4-yl]-5-(4-methoxyphenyl)-2-methyl-3-pyrazolecarboxamide::N-[1-(2-fluorophenyl)-4,5,6,7-tetrahydroindazol-4-yl]-5-(4-methoxyphenyl)-2-methyl-pyrazole-3-carboxamide::N-[1-(2-fluorophenyl)-4,5,6,7-tetrahydroindazol-4-yl]-5-(4-methoxyphenyl)-2-methylpyrazole-3-carboxamide::cid_44543509
SMILES: COc1ccc(cc1)-c1cc(C(=O)NC2CCCc3c2cnn3-c2ccccc2F)n(C)n1
InChI Key: InChIKey=JDMDWRLYDBPJEO-UHFFFAOYSA-N
Data: 3 IC50
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
nucleotide-binding oligomerization domain containing 1 (Homo sapiens (Human)) | BDBM62338 (MLS-0425704.0001 | N-[1-(2-fluorophenyl)-4,5,6,7-t...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | 990 | n/a | n/a | n/a | n/a | n/a | n/a |
Burnham Center for Chemical Genomics Curated by PubChem BioAssay | Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C... | PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2Z899VD | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Tumor necrosis factor (Homo sapiens (Human)) | BDBM62338 (MLS-0425704.0001 | N-[1-(2-fluorophenyl)-4,5,6,7-t...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | 1.36E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Burnham Center for Chemical Genomics Curated by PubChem BioAssay | Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C... | PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2PR7TDC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
nucleotide-binding oligomerization domain containing 2 (Homo sapiens (Human)) | BDBM62338 (MLS-0425704.0001 | N-[1-(2-fluorophenyl)-4,5,6,7-t...) | PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | 1.34E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Burnham Center for Chemical Genomics Curated by PubChem BioAssay | Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C... | PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2TH8K43 | |||||||||||
More data for this Ligand-Target Pair |