Compile Data Set for Download or QSAR

Found 103 hits Enz. Inhib. hit(s) with all data for entry = 2407   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364467 (US9862707, Example 41) Show SMILES Cn1ccc(n1)-c1cc(C(=O)Nc2n(nc3cc(cnc23)C(C)(C)O)-c2ccccc2)c(F)cc1C(F)(F)F Show InChI InChI=1S/C27H22F4N6O2/c1-26(2,39)15-11-22-23(32-14-15)24(37(35-22)16-7-5-4-6-8-16)33-25(38)18-12-17(21-9-10-36(3)34-21)19(13-20(18)28)27(29,30)31/h4-14,39H,1-3H3,(H,33,38)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.160	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364459 ((R or S)-2-fluoro-N-[6-(1- hydroxyethyl)-2-phenyl-...) Show SMILES CC(O)c1cnc2c(NC(=O)c3cc(-c4ccn(C)n4)c(cc3F)C(F)(F)F)n(nc2c1)-c1ccccc1 Show InChI InChI=1S/C26H20F4N6O2/c1-14(37)15-10-22-23(31-13-15)24(36(34-22)16-6-4-3-5-7-16)32-25(38)18-11-17(21-8-9-35(2)33-21)19(12-20(18)27)26(28,29)30/h3-14,37H,1-2H3,(H,32,38)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.25	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364459 ((R or S)-2-fluoro-N-[6-(1- hydroxyethyl)-2-phenyl-...) Show SMILES CC(O)c1cnc2c(NC(=O)c3cc(-c4ccn(C)n4)c(cc3F)C(F)(F)F)n(nc2c1)-c1ccccc1 Show InChI InChI=1S/C26H20F4N6O2/c1-14(37)15-10-22-23(31-13-15)24(36(34-22)16-6-4-3-5-7-16)32-25(38)18-11-17(21-8-9-35(2)33-21)19(12-20(18)27)26(28,29)30/h3-14,37H,1-2H3,(H,32,38)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.480	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364499 (US9862707, Example 74) Show SMILES Cn1ccc(n1)-c1cc(C(=O)Nc2n(nc3cc(ccc23)C(N)=O)-c2ccccc2)c(F)cc1C(F)(F)F Show InChI InChI=1S/C26H18F4N6O2/c1-35-10-9-21(33-35)17-12-18(20(27)13-19(17)26(28,29)30)25(38)32-24-16-8-7-14(23(31)37)11-22(16)34-36(24)15-5-3-2-4-6-15/h2-13H,1H3,(H2,31,37)(H,32,38)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.570	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364512 (3-({[2-fluoro-5-(1-methyl-1H- pyrazol-3-yl)-4- (tr...) Show SMILES Cn1ccc(n1)-c1cc(C(=O)Nc2n(nc3cc(cnc23)C(N)=O)-c2ccccc2)c(F)cc1C(F)(F)F Show InChI InChI=1S/C25H17F4N7O2/c1-35-8-7-19(33-35)15-10-16(18(26)11-17(15)25(27,28)29)24(38)32-23-21-20(9-13(12-31-21)22(30)37)34-36(23)14-5-3-2-4-6-14/h2-12H,1H3,(H2,30,37)(H,32,38)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.630	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364520 (US9862707, Example 95) Show SMILES Cn1ccc(n1)-c1cc(C(=O)Nc2n(nc3c(CC(N)=O)cccc23)-c2ccccc2)c(F)cc1C(F)(F)F Show InChI InChI=1S/C27H20F4N6O2/c1-36-11-10-22(34-36)18-13-19(21(28)14-20(18)27(29,30)31)26(39)33-25-17-9-5-6-15(12-23(32)38)24(17)35-37(25)16-7-3-2-4-8-16/h2-11,13-14H,12H2,1H3,(H2,32,38)(H,33,39)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.640	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364431 (2-fluoro-5-(1-methyl-1H-pyrazol-3- yl)-N-(2-phenyl...) Show SMILES Cn1ccc(n1)-c1cc(C(=O)Nc2n(nc3cccnc23)-c2ccccc2)c(F)cc1C(F)(F)F Show InChI InChI=1S/C24H16F4N6O/c1-33-11-9-19(31-33)15-12-16(18(25)13-17(15)24(26,27)28)23(35)30-22-21-20(8-5-10-29-21)32-34(22)14-6-3-2-4-7-14/h2-13H,1H3,(H,30,35)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.660	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364447 (US9862707, Example 21 | US9862707, Example 22) Show SMILES CC(O)c1cnc2c(NC(=O)c3cc(-c4cc[nH]n4)c(cc3F)C(F)(F)F)n(nc2c1)-c1ccccc1 Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.690	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364480 ((R or S)-2-fluoro-N-(2-phenyl-5- (2,2,2-trifluoro-...) Show SMILES OC(c1ccc2nn(c(NC(=O)c3cc(-c4ncccn4)c(cc3F)C(F)(F)F)c2c1)-c1ccccc1)C(F)(F)F Show InChI InChI=1S/C27H16F7N5O2/c28-20-13-19(26(29,30)31)16(23-35-9-4-10-36-23)12-17(20)25(41)37-24-18-11-14(22(40)27(32,33)34)7-8-21(18)38-39(24)15-5-2-1-3-6-15/h1-13,22,40H,(H,37,41)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.820	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364436 (US9862707, Example 10) Show SMILES Cn1ccc(n1)-c1cc(ccc1C(F)(F)F)C(=O)Nc1n(nc2ccc(CO)cc12)-c1ccccc1 Show InChI InChI=1S/C26H20F3N5O2/c1-33-12-11-23(31-33)19-14-17(8-9-21(19)26(27,28)29)25(36)30-24-20-13-16(15-35)7-10-22(20)32-34(24)18-5-3-2-4-6-18/h2-14,35H,15H2,1H3,(H,30,36)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.840	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364524 (N-(7-((2,5-dioxoimidazolidin-1- yl)methyl)-2-pheny...) Show SMILES Cn1ccc(n1)-c1cc(C(=O)Nc2n(nc3c(CN4C(=O)CNC4=O)ccnc23)-c2ccccc2)c(F)cc1C(F)(F)F Show InChI InChI=1S/C28H20F4N8O3/c1-38-10-8-21(36-38)17-11-18(20(29)12-19(17)28(30,31)32)26(42)35-25-24-23(37-40(25)16-5-3-2-4-6-16)15(7-9-33-24)14-39-22(41)13-34-27(39)43/h2-12H,13-14H2,1H3,(H,34,43)(H,35,42)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.880	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364455 ((R or S)-2-fluoro-N-[6-(1- hydroxyethyl)-2-phenyl-...) Show SMILES CC(O)c1cnc2c(NC(=O)c3cc(-c4ncccn4)c(cc3F)C(F)(F)F)n(nc2c1)-c1ccccc1 Show InChI InChI=1S/C26H18F4N6O2/c1-14(37)15-10-21-22(33-13-15)24(36(35-21)16-6-3-2-4-7-16)34-25(38)18-11-17(23-31-8-5-9-32-23)19(12-20(18)27)26(28,29)30/h2-14,37H,1H3,(H,34,38)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.10	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364440 (2-fluoro-N-[6-(hydroxymethyl)-2- phenyl-2H-indazol...) Show SMILES OCc1ccc2c(NC(=O)c3cc(-c4cc[nH]n4)c(cc3F)C(F)(F)F)n(nc2c1)-c1ccccc1 Show InChI InChI=1S/C25H17F4N5O2/c26-20-12-19(25(27,28)29)17(21-8-9-30-32-21)11-18(20)24(36)31-23-16-7-6-14(13-35)10-22(16)33-34(23)15-4-2-1-3-5-15/h1-12,35H,13H2,(H,30,32)(H,31,36)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.20	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364447 (US9862707, Example 21 | US9862707, Example 22) Show SMILES CC(O)c1cnc2c(NC(=O)c3cc(-c4cc[nH]n4)c(cc3F)C(F)(F)F)n(nc2c1)-c1ccccc1 Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.20	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364502 (US9862707, Example 77) Show SMILES Cc1ccccc1-n1nc2cc(ccc2c1NC(=O)c1cc(-c2ccn(C)n2)c(cc1F)C(F)(F)F)C(N)=O Show InChI InChI=1S/C27H20F4N6O2/c1-14-5-3-4-6-23(14)37-25(16-8-7-15(24(32)38)11-22(16)35-37)33-26(39)18-12-17(21-9-10-36(2)34-21)19(13-20(18)28)27(29,30)31/h3-13H,1-2H3,(H2,32,38)(H,33,39)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.30	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364476 (US9862707, Example 50) Show SMILES OC1(CC1)c1cnc2c(NC(=O)c3cc(-c4ncccn4)c(cc3F)C(F)(F)F)n(nc2c1)-c1ccccc1 Show InChI InChI=1S/C27H18F4N6O2/c28-20-13-19(27(29,30)31)17(23-32-9-4-10-33-23)12-18(20)25(38)35-24-22-21(11-15(14-34-22)26(39)7-8-26)36-37(24)16-5-2-1-3-6-16/h1-6,9-14,39H,7-8H2,(H,35,38)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.60	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364461 ((R or S)-2-chloro-N-[6-(1- hydroxyethyl)-2-phenyl-...) Show SMILES CC(O)c1cnc2c(NC(=O)c3cc(-c4ncccn4)c(cc3Cl)C(F)(F)F)n(nc2c1)-c1ccccc1 Show InChI InChI=1S/C26H18ClF3N6O2/c1-14(37)15-10-21-22(33-13-15)24(36(35-21)16-6-3-2-4-7-16)34-25(38)18-11-17(23-31-8-5-9-32-23)19(12-20(18)27)26(28,29)30/h2-14,37H,1H3,(H,34,38)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.70	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364472 (2-chloro-N-[6-(1-hydroxy-1- methylethyl)-2-phenyl-...) Show SMILES CC(C)(O)c1ccc2c(NC(=O)c3cc(-c4ncccn4)c(cc3Cl)C(F)(F)F)n(nc2c1)-c1ccccc1 Show InChI InChI=1S/C28H21ClF3N5O2/c1-27(2,39)16-9-10-18-23(13-16)36-37(17-7-4-3-5-8-17)25(18)35-26(38)20-14-19(24-33-11-6-12-34-24)21(15-22(20)29)28(30,31)32/h3-15,39H,1-2H3,(H,35,38)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.70	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364526 (US9862707, Example 101) Show SMILES Cn1ccc(n1)-c1cc(ccc1C(F)(F)F)C(=O)Nc1n(nc2cc(ccc12)[C@H](N)C(F)(F)F)-c1ccccc1 |r| Show InChI InChI=1S/C27H20F6N6O/c1-38-12-11-21(36-38)19-13-16(8-10-20(19)26(28,29)30)25(40)35-24-18-9-7-15(23(34)27(31,32)33)14-22(18)37-39(24)17-5-3-2-4-6-17/h2-14,23H,34H2,1H3,(H,35,40)/t23-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.80	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364496 (N-[6-(aminomethyl)-2-phenyl-2H- indazol-3-yl]-2-fl...) Show SMILES Cn1ccc(n1)-c1cc(C(=O)Nc2n(nc3cc(CN)ccc23)-c2ccccc2)c(F)cc1C(F)(F)F Show InChI InChI=1S/C26H20F4N6O/c1-35-10-9-22(33-35)18-12-19(21(27)13-20(18)26(28,29)30)25(37)32-24-17-8-7-15(14-31)11-23(17)34-36(24)16-5-3-2-4-6-16/h2-13H,14,31H2,1H3,(H,32,37)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.80	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364455 ((R or S)-2-fluoro-N-[6-(1- hydroxyethyl)-2-phenyl-...) Show SMILES CC(O)c1cnc2c(NC(=O)c3cc(-c4ncccn4)c(cc3F)C(F)(F)F)n(nc2c1)-c1ccccc1 Show InChI InChI=1S/C26H18F4N6O2/c1-14(37)15-10-21-22(33-13-15)24(36(35-21)16-6-3-2-4-7-16)34-25(38)18-11-17(23-31-8-5-9-32-23)19(12-20(18)27)26(28,29)30/h2-14,37H,1H3,(H,34,38)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.80	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364444 (2-fluoro-N-[5-(hydroxymethyl)-2- phenyl-2H-pyrazol...) Show SMILES Cn1ccc(n1)-c1cc(C(=O)Nc2n(nc3cnc(CO)cc23)-c2ccccc2)c(F)cc1C(F)(F)F Show InChI InChI=1S/C25H18F4N6O2/c1-34-8-7-21(32-34)16-10-17(20(26)11-19(16)25(27,28)29)24(37)31-23-18-9-14(13-36)30-12-22(18)33-35(23)15-5-3-2-4-6-15/h2-12,36H,13H2,1H3,(H,31,37)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.90	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364445 (US9862707, Example 19 | US9862707, Example 20) Show SMILES CC(O)c1ccc2c(NC(=O)c3cc(-c4ncccn4)c(cc3F)C(F)(F)F)n(nc2c1)-c1ccccc1 Show InChI InChI=1S/C27H19F4N5O2/c1-15(37)16-8-9-18-23(12-16)35-36(17-6-3-2-4-7-17)25(18)34-26(38)20-13-19(24-32-10-5-11-33-24)21(14-22(20)28)27(29,30)31/h2-15,37H,1H3,(H,34,38)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.90	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364486 (US9862707, Example 60) Show SMILES OCCc1ccc2c(NC(=O)c3cc(-c4ncccn4)c(cc3F)C(F)(F)F)n(nc2c1)-c1ccccc1 Show InChI InChI=1S/C27H19F4N5O2/c28-22-15-21(27(29,30)31)19(24-32-10-4-11-33-24)14-20(22)26(38)34-25-18-8-7-16(9-12-37)13-23(18)35-36(25)17-5-2-1-3-6-17/h1-8,10-11,13-15,37H,9,12H2,(H,34,38)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.20	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364461 ((R or S)-2-chloro-N-[6-(1- hydroxyethyl)-2-phenyl-...) Show SMILES CC(O)c1cnc2c(NC(=O)c3cc(-c4ncccn4)c(cc3Cl)C(F)(F)F)n(nc2c1)-c1ccccc1 Show InChI InChI=1S/C26H18ClF3N6O2/c1-14(37)15-10-21-22(33-13-15)24(36(35-21)16-6-3-2-4-7-16)34-25(38)18-11-17(23-31-8-5-9-32-23)19(12-20(18)27)26(28,29)30/h2-14,37H,1H3,(H,34,38)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.40	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364449 ((R or S)-N-[5-(1-hydroxyethyl)-2- phenyl-2H-indazo...) Show SMILES CC(O)c1ccc2nn(c(NC(=O)c3ccc(c(c3)-c3ccn(C)n3)C(F)(F)F)c2c1)-c1ccccc1 Show InChI InChI=1S/C27H22F3N5O2/c1-16(36)17-9-11-23-21(14-17)25(35(33-23)19-6-4-3-5-7-19)31-26(37)18-8-10-22(27(28,29)30)20(15-18)24-12-13-34(2)32-24/h3-16,36H,1-2H3,(H,31,37)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.40	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364509 (3-({[2-fluoro-5-pyridin-2-yl-4- (trifluoromethyl)p...) Show SMILES NC(=O)c1cnc2c(NC(=O)c3cc(-c4ccccn4)c(cc3F)C(F)(F)F)n(nc2c1)-c1ccccc1 Show InChI InChI=1S/C26H16F4N6O2/c27-19-12-18(26(28,29)30)16(20-8-4-5-9-32-20)11-17(19)25(38)34-24-22-21(10-14(13-33-22)23(31)37)35-36(24)15-6-2-1-3-7-15/h1-13H,(H2,31,37)(H,34,38)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.60	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364438 (2-fluoro-N-[5-(hydroxymethyl)-2- phenyl-2H-indazol...) Show SMILES OCc1ccc2nn(c(NC(=O)c3cc(-c4ncccn4)c(cc3F)C(F)(F)F)c2c1)-c1ccccc1 Show InChI InChI=1S/C26H17F4N5O2/c27-21-13-20(26(28,29)30)17(23-31-9-4-10-32-23)12-18(21)25(37)33-24-19-11-15(14-36)7-8-22(19)34-35(24)16-5-2-1-3-6-16/h1-13,36H,14H2,(H,33,37)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.60	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364473 (2-fluoro-N-[6-(1-hydroxy-1- methylethyl)-2-phenyl-...) Show SMILES CC(C)(O)c1cnc2c(NC(=O)c3cc(-c4cc[nH]n4)c(cc3F)C(F)(F)F)n(nc2c1)-c1ccccc1 Show InChI InChI=1S/C26H20F4N6O2/c1-25(2,38)14-10-21-22(31-13-14)23(36(35-21)15-6-4-3-5-7-15)33-24(37)17-11-16(20-8-9-32-34-20)18(12-19(17)27)26(28,29)30/h3-13,38H,1-2H3,(H,32,34)(H,33,37)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.60	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364507 (3-({[3-(1-methyl-1H-pyrazol-3-yl)- 4- (trifluorome...) Show SMILES Cn1ccc(n1)-c1cc(ccc1C(F)(F)F)C(=O)Nc1n(nc2cc(ccc12)C(N)=O)-c1ccccc1 Show InChI InChI=1S/C26H19F3N6O2/c1-34-12-11-21(32-34)19-13-16(8-10-20(19)26(27,28)29)25(37)31-24-18-9-7-15(23(30)36)14-22(18)33-35(24)17-5-3-2-4-6-17/h2-14H,1H3,(H2,30,36)(H,31,37)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.70	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364470 (US9862707, Example 44) Show SMILES CC(C)(O)c1ccc2nn(c(NC(=O)c3cc(-c4ncccn4)c(cc3F)C(F)(F)F)c2c1)-c1ccccc1 Show InChI InChI=1S/C28H21F4N5O2/c1-27(2,39)16-9-10-23-20(13-16)25(37(36-23)17-7-4-3-5-8-17)35-26(38)19-14-18(24-33-11-6-12-34-24)21(15-22(19)29)28(30,31)32/h3-15,39H,1-2H3,(H,35,38)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.70	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364525 (US9862707, Example 100) Show SMILES Cn1ccc(n1)-c1cc(ccc1C(F)(F)F)C(=O)Nc1n(nc2cc(ccc12)[C@@H](N)C(F)(F)F)-c1ccccc1 |r| Show InChI InChI=1S/C27H20F6N6O/c1-38-12-11-21(36-38)19-13-16(8-10-20(19)26(28,29)30)25(40)35-24-18-9-7-15(23(34)27(31,32)33)14-22(18)37-39(24)17-5-3-2-4-6-17/h2-14,23H,34H2,1H3,(H,35,40)/t23-/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.70	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364511 (3-({[3-(1-methyl-1H-pyrazol-3-yl)- 4- (trifluorome...) Show SMILES Cn1ccc(n1)-c1cc(ccc1C(F)(F)F)C(=O)Nc1n(nc2cc(cnc12)C(N)=O)-c1ccccc1 Show InChI InChI=1S/C25H18F3N7O2/c1-34-10-9-19(32-34)17-11-14(7-8-18(17)25(26,27)28)24(37)31-23-21-20(12-15(13-30-21)22(29)36)33-35(23)16-5-3-2-4-6-16/h2-13H,1H3,(H2,29,36)(H,31,37)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.80	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364482 ((R or S)-N-[6-(2,2-difluoro-1- hydroxyethyl)-2-phe...) Show SMILES OC(C(F)F)c1ccc2c(NC(=O)c3cc(-c4ncccn4)c(cc3F)C(F)(F)F)n(nc2c1)-c1ccccc1 Show InChI InChI=1S/C27H17F6N5O2/c28-20-13-19(27(31,32)33)17(24-34-9-4-10-35-24)12-18(20)26(40)36-25-16-8-7-14(22(39)23(29)30)11-21(16)37-38(25)15-5-2-1-3-6-15/h1-13,22-23,39H,(H,36,40)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.80	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364478 (US9862707, Example 52 | US9862707, Example 53) Show SMILES OC(c1ccc2c(NC(=O)c3cc(-c4ncccn4)c(cc3F)C(F)(F)F)n(nc2c1)-c1ccccc1)C(F)(F)F Show InChI InChI=1S/C27H16F7N5O2/c28-20-13-19(26(29,30)31)17(23-35-9-4-10-36-23)12-18(20)25(41)37-24-16-8-7-14(22(40)27(32,33)34)11-21(16)38-39(24)15-5-2-1-3-6-15/h1-13,22,40H,(H,37,41)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.80	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364506 (3-({[2-fluoro-5-pyridin-2-yl-4- (trifluoromethyl)p...) Show SMILES NC(=O)c1ccc2c(NC(=O)c3cc(-c4ccccn4)c(cc3F)C(F)(F)F)n(nc2c1)-c1ccccc1 Show InChI InChI=1S/C27H17F4N5O2/c28-21-14-20(27(29,30)31)18(22-8-4-5-11-33-22)13-19(21)26(38)34-25-17-10-9-15(24(32)37)12-23(17)35-36(25)16-6-2-1-3-7-16/h1-14H,(H2,32,37)(H,34,38)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.90	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364445 (US9862707, Example 19 | US9862707, Example 20) Show SMILES CC(O)c1ccc2c(NC(=O)c3cc(-c4ncccn4)c(cc3F)C(F)(F)F)n(nc2c1)-c1ccccc1 Show InChI InChI=1S/C27H19F4N5O2/c1-15(37)16-8-9-18-23(12-16)35-36(17-6-3-2-4-7-17)25(18)34-26(38)20-13-19(24-32-10-5-11-33-24)21(14-22(20)28)27(29,30)31/h2-15,37H,1H3,(H,34,38)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.90	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364487 (2-fluoro-N-[5-(2-hydroxyethyl)-2- phenyl-2H-indazo...) Show SMILES OCCc1ccc2nn(c(NC(=O)c3cc(-c4ncccn4)c(cc3F)C(F)(F)F)c2c1)-c1ccccc1 Show InChI InChI=1S/C27H19F4N5O2/c28-22-15-21(27(29,30)31)18(24-32-10-4-11-33-24)14-19(22)26(38)34-25-20-13-16(9-12-37)7-8-23(20)35-36(25)17-5-2-1-3-6-17/h1-8,10-11,13-15,37H,9,12H2,(H,34,38)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.10	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364498 (US9862707, Example 73) Show SMILES NC(=O)c1ccc2c(NC(=O)c3cc(-c4ncccn4)c(cc3F)C(F)(F)F)n(nc2c1)-c1ccccc1 Show InChI InChI=1S/C26H16F4N6O2/c27-20-13-19(26(28,29)30)17(23-32-9-4-10-33-23)12-18(20)25(38)34-24-16-8-7-14(22(31)37)11-21(16)35-36(24)15-5-2-1-3-6-15/h1-13H,(H2,31,37)(H,34,38)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.10	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364510 (3-({[2-chloro-5-pyridin-2-yl-4- (trifluoromethyl)p...) Show SMILES NC(=O)c1cnc2c(NC(=O)c3cc(-c4ccccn4)c(cc3Cl)C(F)(F)F)n(nc2c1)-c1ccccc1 Show InChI InChI=1S/C26H16ClF3N6O2/c27-19-12-18(26(28,29)30)16(20-8-4-5-9-32-20)11-17(19)25(38)34-24-22-21(10-14(13-33-22)23(31)37)35-36(24)15-6-2-1-3-7-15/h1-13H,(H2,31,37)(H,34,38)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.30	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364503 (3-({[2-fluoro-5-(1H-pyrazol-3-yl)- 4- (trifluorome...) Show SMILES NC(=O)c1ccc2c(NC(=O)c3cc(-c4cc[nH]n4)c(cc3F)C(F)(F)F)n(nc2c1)-c1ccccc1 Show InChI InChI=1S/C25H16F4N6O2/c26-19-12-18(25(27,28)29)16(20-8-9-31-33-20)11-17(19)24(37)32-23-15-7-6-13(22(30)36)10-21(15)34-35(23)14-4-2-1-3-5-14/h1-12H,(H2,30,36)(H,31,33)(H,32,37)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.60	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364449 ((R or S)-N-[5-(1-hydroxyethyl)-2- phenyl-2H-indazo...) Show SMILES CC(O)c1ccc2nn(c(NC(=O)c3ccc(c(c3)-c3ccn(C)n3)C(F)(F)F)c2c1)-c1ccccc1 Show InChI InChI=1S/C27H22F3N5O2/c1-16(36)17-9-11-23-21(14-17)25(35(33-23)19-6-4-3-5-7-19)31-26(37)18-8-10-22(27(28,29)30)20(15-18)24-12-13-34(2)32-24/h3-16,36H,1-2H3,(H,31,37)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.70	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364439 (2-fluoro-N-[6-(hydroxymethyl)-2- phenyl-2H-indazol...) Show SMILES OCc1ccc2c(NC(=O)c3cc(-c4ncccn4)c(cc3F)C(F)(F)F)n(nc2c1)-c1ccccc1 Show InChI InChI=1S/C26H17F4N5O2/c27-21-13-20(26(28,29)30)18(23-31-9-4-10-32-23)12-19(21)25(37)33-24-17-8-7-15(14-36)11-22(17)34-35(24)16-5-2-1-3-6-16/h1-13,36H,14H2,(H,33,37)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.80	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364466 (US9862707, Example 40) Show SMILES CC(C)(O)c1cnc2c(NC(=O)c3cc(-c4ncccn4)c(cc3F)C(F)(F)F)n(nc2c1)-c1ccccc1 Show InChI InChI=1S/C27H20F4N6O2/c1-26(2,39)15-11-21-22(34-14-15)24(37(36-21)16-7-4-3-5-8-16)35-25(38)18-12-17(23-32-9-6-10-33-23)19(13-20(18)28)27(29,30)31/h3-14,39H,1-2H3,(H,35,38)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.90	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364463 ((R or S)-2-chloro-N-[6-(1- hydroxyethyl)-2-phenyl-...) Show SMILES CC(O)c1ccc2c(NC(=O)c3cc(-c4ncccn4)c(cc3Cl)C(F)(F)F)n(nc2c1)-c1ccccc1 Show InChI InChI=1S/C27H19ClF3N5O2/c1-15(37)16-8-9-18-23(12-16)35-36(17-6-3-2-4-7-17)25(18)34-26(38)20-13-19(24-32-10-5-11-33-24)21(14-22(20)28)27(29,30)31/h2-15,37H,1H3,(H,34,38)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.40	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364519 (US9862707, Example 94) Show SMILES NC(=O)Cc1ccc2c(NC(=O)c3cc(-c4ncccn4)c(cc3F)C(F)(F)F)n(nc2c1)-c1ccccc1 Show InChI InChI=1S/C27H18F4N6O2/c28-21-14-20(27(29,30)31)18(24-33-9-4-10-34-24)13-19(21)26(39)35-25-17-8-7-15(12-23(32)38)11-22(17)36-37(25)16-5-2-1-3-6-16/h1-11,13-14H,12H2,(H2,32,38)(H,35,39)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.40	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364474 (N-[6-(1-hydroxy-1-methylethyl)-2- phenyl-2H-pyrazo...) Show SMILES Cn1ccc(n1)-c1cc(ccc1C(F)(F)F)C(=O)Nc1n(nc2cc(cnc12)C(C)(C)O)-c1ccccc1 Show InChI InChI=1S/C27H23F3N6O2/c1-26(2,38)17-14-22-23(31-15-17)24(36(34-22)18-7-5-4-6-8-18)32-25(37)16-9-10-20(27(28,29)30)19(13-16)21-11-12-35(3)33-21/h4-15,38H,1-3H3,(H,32,37)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.60	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364468 (US9862707, Example 42) Show SMILES CC(C)(O)c1ccc2c(NC(=O)c3cc(-c4ncccn4)c(cc3F)C(F)(F)F)n(nc2c1)-c1ccccc1 Show InChI InChI=1S/C28H21F4N5O2/c1-27(2,39)16-9-10-18-23(13-16)36-37(17-7-4-3-5-8-17)25(18)35-26(38)20-14-19(24-33-11-6-12-34-24)21(15-22(20)29)28(30,31)32/h3-15,39H,1-2H3,(H,35,38)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.60	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364463 ((R or S)-2-chloro-N-[6-(1- hydroxyethyl)-2-phenyl-...) Show SMILES CC(O)c1ccc2c(NC(=O)c3cc(-c4ncccn4)c(cc3Cl)C(F)(F)F)n(nc2c1)-c1ccccc1 Show InChI InChI=1S/C27H19ClF3N5O2/c1-15(37)16-8-9-18-23(12-16)35-36(17-6-3-2-4-7-17)25(18)34-26(38)20-13-19(24-32-10-5-11-33-24)21(14-22(20)28)27(29,30)31/h2-15,37H,1H3,(H,34,38)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.90	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM364484 ((R or S)-N-[5-(2,2-difluoro-1- hydroxyethyl)-2-phe...) Show SMILES OC(C(F)F)c1ccc2nn(c(NC(=O)c3cc(-c4ncccn4)c(cc3F)C(F)(F)F)c2c1)-c1ccccc1 Show InChI InChI=1S/C27H17F6N5O2/c28-20-13-19(27(31,32)33)16(24-34-9-4-10-35-24)12-17(20)26(40)36-25-18-11-14(22(39)23(29)30)7-8-21(18)37-38(25)15-5-2-1-3-6-15/h1-13,22-23,39H,(H,36,40)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.90	n/a	n/a	n/a	n/a	n/a	n/a
Rheinische Friedrich-Wilhelms-Universitat Bonn					Assay Description TrkA functional activity was measured using a DiscoverX PathHunter assay. In this assay, U2OS cells express the human TrkA receptor as a fusion with ...				J Med Chem 48: 7688-707 (2005) BindingDB Entry DOI: 10.7270/Q2FB5576
					More data for this Ligand-Target Pair

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