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SMILES: CNCCNc1cc(ccn1)C(=O)NC[C@H](O)CN1CCc2ccccc2C1

InChI Key: InChIKey=ABQCOLVKOOQFCC-IBGZPJMESA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 179393   

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
Protein arginine N-methyltransferase 5 (Homo sapiens (Human))	BDBM179393 (US10307413, Compound 314 | US10391089, Compound 31...) Show SMILES CNCCNc1cc(ccn1)C(=O)NC[C@H](O)CN1CCc2ccccc2C1 |r| Show InChI InChI=1S/C21H29N5O2/c1-22-9-10-24-20-12-17(6-8-23-20)21(28)25-13-19(27)15-26-11-7-16-4-2-3-5-18(16)14-26/h2-6,8,12,19,22,27H,7,9-11,13-15H2,1H3,(H,23,24)(H,25,28)/t19-/m0/s1	PDB UniProtKB/SwissProt antibodypedia 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
Epizyme, Inc. US Patent					Assay Description The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....				US Patent US9675614 (2017) BindingDB Entry DOI: 10.7270/Q2MW2F9B
					More data for this Ligand-Target Pair
Protein arginine N-methyltransferase 5 (Homo sapiens (Human))	BDBM179393 (US10307413, Compound 314 | US10391089, Compound 31...) Show SMILES CNCCNc1cc(ccn1)C(=O)NC[C@H](O)CN1CCc2ccccc2C1 |r| Show InChI InChI=1S/C21H29N5O2/c1-22-9-10-24-20-12-17(6-8-23-20)21(28)25-13-19(27)15-26-11-7-16-4-2-3-5-18(16)14-26/h2-6,8,12,19,22,27H,7,9-11,13-15H2,1H3,(H,23,24)(H,25,28)/t19-/m0/s1	PDB UniProtKB/SwissProt antibodypedia 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
Epizyme, Inc. US Patent					Assay Description The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....				US Patent US10980794 (2021) BindingDB Entry DOI: 10.7270/Q25X2D23
					More data for this Ligand-Target Pair
Methylosome protein 50/Protein arginine N-methyltransferase 5 (Homo sapiens (Human))	BDBM179393 (US10307413, Compound 314 | US10391089, Compound 31...) Show SMILES CNCCNc1cc(ccn1)C(=O)NC[C@H](O)CN1CCc2ccccc2C1 |r| Show InChI InChI=1S/C21H29N5O2/c1-22-9-10-24-20-12-17(6-8-23-20)21(28)25-13-19(27)15-26-11-7-16-4-2-3-5-18(16)14-26/h2-6,8,12,19,22,27H,7,9-11,13-15H2,1H3,(H,23,24)(H,25,28)/t19-/m0/s1	PDB UniProtKB/SwissProt B.MOAD DrugBank 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
Epizyme, Inc. US Patent					Assay Description The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....				US Patent US10391089 (2019) BindingDB Entry DOI: 10.7270/Q2RN3B7D
					More data for this Ligand-Target Pair
Protein arginine N-methyltransferase 5 (Homo sapiens (Human))	BDBM179393 (US10307413, Compound 314 | US10391089, Compound 31...) Show SMILES CNCCNc1cc(ccn1)C(=O)NC[C@H](O)CN1CCc2ccccc2C1 |r| Show InChI InChI=1S/C21H29N5O2/c1-22-9-10-24-20-12-17(6-8-23-20)21(28)25-13-19(27)15-26-11-7-16-4-2-3-5-18(16)14-26/h2-6,8,12,19,22,27H,7,9-11,13-15H2,1H3,(H,23,24)(H,25,28)/t19-/m0/s1	PDB UniProtKB/SwissProt antibodypedia 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
Bristol-Myers Squibb Company					Assay Description The assays were all performed in a buffer consisting of 20 mM Bicine (pH=7.6), 1 mM TCEP, 0.005% BSG, and 0.002% Tween20, prepared on the day of use....				J Med Chem 52: 3073-83 (2009) BindingDB Entry DOI: 10.7270/Q2ZG6VMT
					More data for this Ligand-Target Pair