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SMILES: CCc1cc(cnn1)-c1nc2ccc(F)cc2n1C1CC1

InChI Key: InChIKey=GJHNJNULLGQEDQ-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 287628   

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
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM287628 (US10085984, Example 6 | US11040034, Ex. No. 6) Show SMILES CCc1cc(cnn1)-c1nc2ccc(F)cc2n1C1CC1 Show InChI InChI=1S/C16H15FN4/c1-2-12-7-10(9-18-20-12)16-19-14-6-3-11(17)8-15(14)21(16)13-4-5-13/h3,6-9,13H,2,4-5H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/a
Viamet Pharmaceuticals (Bermuda), Ltd. US Patent					Assay Description V79-4 cells expressing recombinant andrenodoxin and andrenodoxin reductase with either recombinant human CYP11B2 or CYP11B1 were prepared according t...				US Patent US10085984 (2018) BindingDB Entry DOI: 10.7270/Q2542QM2
					More data for this Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial (Homo sapiens (Human))	BDBM287628 (US10085984, Example 6 | US11040034, Ex. No. 6) Show SMILES CCc1cc(cnn1)-c1nc2ccc(F)cc2n1C1CC1 Show InChI InChI=1S/C16H15FN4/c1-2-12-7-10(9-18-20-12)16-19-14-6-3-11(17)8-15(14)21(16)13-4-5-13/h3,6-9,13H,2,4-5H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	5.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM287628 (US10085984, Example 6 | US11040034, Ex. No. 6) Show SMILES CCc1cc(cnn1)-c1nc2ccc(F)cc2n1C1CC1 Show InChI InChI=1S/C16H15FN4/c1-2-12-7-10(9-18-20-12)16-19-14-6-3-11(17)8-15(14)21(16)13-4-5-13/h3,6-9,13H,2,4-5H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial (Homo sapiens (Human))	BDBM287628 (US10085984, Example 6 | US11040034, Ex. No. 6) Show SMILES CCc1cc(cnn1)-c1nc2ccc(F)cc2n1C1CC1 Show InChI InChI=1S/C16H15FN4/c1-2-12-7-10(9-18-20-12)16-19-14-6-3-11(17)8-15(14)21(16)13-4-5-13/h3,6-9,13H,2,4-5H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	750	n/a	n/a	n/a	n/a	n/a	n/a
Viamet Pharmaceuticals (Bermuda), Ltd. US Patent					Assay Description V79-4 cells expressing recombinant andrenodoxin and andrenodoxin reductase with either recombinant human CYP11B2 or CYP11B1 were prepared according t...				US Patent US10085984 (2018) BindingDB Entry DOI: 10.7270/Q2542QM2
					More data for this Ligand-Target Pair