<p>The table summarizes, for each compound, the Ambinter-code, the molecular weight, the experimental IC<sub>50</sub>, K<sub>i</sub>′ values, and the BE. n.d., not determined.</p
<p>All hit compounds identified were chemical clustered using pubchem finger prints. (A) The major c...
<p>The table includes their IC<sub>50</sub> in the Gli-Luciferase assay in <i>Ptch1</i><sup><i>-/-</...
<p>Structures of highest-scoring 8 compounds identified in the high-throughput virtual screening cho...
<p>MACCS structural keys system (BIT_packed) and the Tanimoto coefficient were used as fingerprint s...
<p>The table summarizes, for each compound, the ZINC-code, the Ambinter-code, the molecular weight, ...
<p>Structures were generated by CambridgeSoft ChemDraw Ultra 7.0 (Cambridge, MA). NI = No Inhibition...
Compounds used in this work. Each row includes: compound ID; SMILES; molecular weight; assignment to...
<p>A set of 6941 analog series and associated data are provided. These series exclusively consist of...
<p>Triage of the primary screening hits made use of local hit rate analysis; ligand efficiency again...
<p>The mean and the SEM of IC<sub>50</sub> values (µM) of the tested compounds on STAT3- and STAT5b-...
<p>A) Flowchart of the screening of the 10,000 compound library DIVER Set. 10,000 compounds were scr...
<p>The chemical structure of four related compounds identified by virtual screening that were valida...
<p>Shown are the eighteen compounds, their stick structures and chemical names. The qHTS IC<sub>50</...
Close structural relationships between approved drugs and bioactive compounds were systematically a...
<p><sup><i>a</i></sup><i>K</i><sub>i</sub> values are shown in parenthesis. <sup><i>b</i></sup>% inh...
<p>All hit compounds identified were chemical clustered using pubchem finger prints. (A) The major c...
<p>The table includes their IC<sub>50</sub> in the Gli-Luciferase assay in <i>Ptch1</i><sup><i>-/-</...
<p>Structures of highest-scoring 8 compounds identified in the high-throughput virtual screening cho...
<p>MACCS structural keys system (BIT_packed) and the Tanimoto coefficient were used as fingerprint s...
<p>The table summarizes, for each compound, the ZINC-code, the Ambinter-code, the molecular weight, ...
<p>Structures were generated by CambridgeSoft ChemDraw Ultra 7.0 (Cambridge, MA). NI = No Inhibition...
Compounds used in this work. Each row includes: compound ID; SMILES; molecular weight; assignment to...
<p>A set of 6941 analog series and associated data are provided. These series exclusively consist of...
<p>Triage of the primary screening hits made use of local hit rate analysis; ligand efficiency again...
<p>The mean and the SEM of IC<sub>50</sub> values (µM) of the tested compounds on STAT3- and STAT5b-...
<p>A) Flowchart of the screening of the 10,000 compound library DIVER Set. 10,000 compounds were scr...
<p>The chemical structure of four related compounds identified by virtual screening that were valida...
<p>Shown are the eighteen compounds, their stick structures and chemical names. The qHTS IC<sub>50</...
Close structural relationships between approved drugs and bioactive compounds were systematically a...
<p><sup><i>a</i></sup><i>K</i><sub>i</sub> values are shown in parenthesis. <sup><i>b</i></sup>% inh...
<p>All hit compounds identified were chemical clustered using pubchem finger prints. (A) The major c...
<p>The table includes their IC<sub>50</sub> in the Gli-Luciferase assay in <i>Ptch1</i><sup><i>-/-</...
<p>Structures of highest-scoring 8 compounds identified in the high-throughput virtual screening cho...