BindingDB Reactant_set_id	Ligand SMILES	Ligand InChI	Ligand InChI Key	BindingDB MonomerID	BindingDB Ligand Name	Target Name	Target Source Organism According to Curator or DataSource	Ki (nM)	IC50 (nM)	Kd (nM)	EC50 (nM)	kon (M-1-s-1)	koff (s-1)	pH	Temp (C)	Curation/DataSource	Article DOI	BindingDB Entry DOI	PMID	PubChem AID	Patent Number	Authors	Institution	Link to Ligand in BindingDB	Link to Target in BindingDB	Link to Ligand-Target Pair in BindingDB	Ligand HET ID in PDB	PDB ID(s) for Ligand-Target Complex	PubChem CID of Ligand	PubChem SID of Ligand	ChEBI ID of Ligand	ChEMBL ID of Ligand	DrugBank ID of Ligand	IUPHAR_GRAC ID of Ligand	KEGG ID of Ligand	ZINC ID of Ligand	Number of Protein Chains in Target (>1 implies a multichain complex)	BindingDB Target Chain Sequence	PDB ID(s) of Target Chain	UniProt (SwissProt) Recommended Name of Target Chain	UniProt (SwissProt) Entry Name of Target Chain	UniProt (SwissProt) Primary ID of Target Chain	UniProt (SwissProt) Secondary ID(s) of Target Chain	UniProt (SwissProt) Alternative ID(s) of Target Chain	UniProt (TrEMBL) Submitted Name of Target Chain	UniProt (TrEMBL) Entry Name of Target Chain	UniProt (TrEMBL) Primary ID of Target Chain	UniProt (TrEMBL) Secondary ID(s) of Target Chain	UniProt (TrEMBL) Alternative ID(s) of Target Chain
668502	COc1cc(Cn2c(CCc3ccccc3)nc3cc(\C=C\C(=O)NO)ccc23)cc(OC)c1OC	InChI=1S/C28H29N3O5/c1-34-24-16-21(17-25(35-2)28(24)36-3)18-31-23-12-9-20(11-14-27(32)30-33)15-22(23)29-26(31)13-10-19-7-5-4-6-8-19/h4-9,11-12,14-17,33H,10,13,18H2,1-3H3,(H,30,32)/b14-11+	QXYMMOVSPDCPIX-SDNWHVSQSA-N	50248375	CHEMBL491688::N-hydroxy-3-(2-phenethyl-1-(3,4,5-trimethoxybenzyl)-1H-benzo[d]imidazol-5-yl)acrylamide::US10201527, Compound 2::US10736881, Compound 2::US8551988, 2	Histone H3.1					 1700					US Patent		10.7270/Q2PK0J7F		aid1797115	US10201527	Chen, D; Song, HY; Sun, ET; Yu, N; Zou, Y	Mei Pharma Inc	http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50248375	http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=557&target=Histone+H3.1&column=ki&startPg=0&Increment=50&submit=Search	http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50248375&enzyme=Histone+H3.1&column=ki&startPg=0&Increment=50&submit=Search			11202590	104103038		CHEMBL491688				ZINC13981301	1	MARTKQTARKSTGGKAPRKQLATKAARKSAPATGGVKKPHRYRPGTVALREIRRYQKSTELLIRKLPFQRLVREIAQDFKTDLRFQSSAVMALQEACEAYLVGLFEDTNLCAIHAKRVTIMPKDIQLARRIRGERA	1P3B,1P3F,1P3G,1P3I,1P3O,1P3P,1U35,2CV5,3AFA,3AV2,3AZI,3AZJ,3AZK,3AZL,3AZM,3AZN,3W96,3W97,3W98,3W99,3WA9,3WAA,3WKJ,3WTP,3X1S,3X1T,3X1U,3X1V,4HGA,4KUD,4YM5,4YM6,4Z2M,5AV5,5AV6,5AV8,5AV9,5AVB,5AVC,5B1M,5B24,5B2I,5B2J,5B31,5B32,5B33,5C3I,5CPI,5CPJ,5CPK,5GSE,5GSU,5GT0,5GT3,5GTC,5JRG,5ONG,5ONW,5X7X,5XF3,5XF4,5XF5,5XM0,5Y0C,5Y0D,5Z30,5ZBA,5ZBB,6A5L,6A5O,6A5P,6A5R,6A5T,6A5U,6HKT,6HTS,6INQ,6IPU,6IQ4,6IR9,6J4W,6J4X,6J4Y,6J4Z,6J50,6J51,6JOU,6JR0,6JR1,6JXD,6K1I,6K1J,6K1K,6KE9,6KVD,6L49,6L4A,6L9H,6L9Z,6LA2,6LA8,6LA9,6LAB,6LE9,6LER,6LTJ,6M3V,6M44,6M4D,6M4G,6M4H,6R0C,6R8Y,6R8Z,6R90,6R91,6R92,6R93,6R94,6RNY,6T90,6T93,6UPK,6UPL,6USJ,6V2K,6V92,6YOV,7BWD,7C0M,7CCQ,7CCR,7COW,7D1Z,7DBP,7K5X,7K5Y,7K60,7K61,7K63,7K7G,7LYA,7LYB,7LYC,7NL0,7SCY,7SCZ,7U0G,7U0I,7U0J,7UD5,7UX9,7V6Q,7V90,7V96,7V9C,7V9J,7V9K,7V9S,7VA4,7VZ4,7W9V,7WBV,7WBW,7WBX,7X57,7X58,7XD1,7XSE,7XSX,7XSZ,7XT7,7XTD,7XTI,7XVL,7XVM,7XX5,7XX6,7XX7,7XZX,7XZY,7XZZ,7Y00,7Y5U,7Y5V,7Y5W,7Y60,7Y61,7Y8R,7YOZ,7YQK,7Z0O,7ZI4,8DK5,8DU4,8GRM,8H0V,8H0W,8H1T,8HAG,8HAH,8HAI,8HAJ,8HAK,8HAL,8HAM,8HAN,8IQF,8IQG,8J6S,8J6T,8OO7,8OOA,8OOP,8OOS,8OSJ,8OSK,8OSL,8OTS,8OTT,8PEP,8SPS,8SPU	Histone H3.1	H31_HUMAN	P68431	A0PJT7 A5PLR1 P02295 P02296 P16106 Q6ISV8 Q6NWP8 Q6NWP9 Q6NXU4 Q71DJ3 Q93081						
668503	CN(C)CC(C)(C)Cn1c(CCc2ccccc2)nc2cc(\C=C\C(=O)NO)ccc12	InChI=1S/C25H32N4O2/c1-25(2,17-28(3)4)18-29-22-13-10-20(12-15-24(30)27-31)16-21(22)26-23(29)14-11-19-8-6-5-7-9-19/h5-10,12-13,15-16,31H,11,14,17-18H2,1-4H3,(H,27,30)/b15-12+	FOLVOXAEHBGIDM-NTCAYCPXSA-N	50248570	3-(1-(3-(dimethylamino)-2,2-dimethylpropyl)-2-phenethyl-1H-benzo[d]imidazol-5-yl)-N-hydroxyacrylamide::CHEMBL460963::US10201527, Compound 17::US10736881, Compound 17::US8551988, 17	Histone H3.1					 1100					US Patent		10.7270/Q2PK0J7F		aid1797115	US10201527	Chen, D; Song, HY; Sun, ET; Yu, N; Zou, Y	Mei Pharma Inc	http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50248570	http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=557&target=Histone+H3.1&column=ki&startPg=0&Increment=50&submit=Search	http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50248570&enzyme=Histone+H3.1&column=ki&startPg=0&Increment=50&submit=Search			44564642	104103208		CHEMBL460963				ZINC13981303	1	MARTKQTARKSTGGKAPRKQLATKAARKSAPATGGVKKPHRYRPGTVALREIRRYQKSTELLIRKLPFQRLVREIAQDFKTDLRFQSSAVMALQEACEAYLVGLFEDTNLCAIHAKRVTIMPKDIQLARRIRGERA	1P3B,1P3F,1P3G,1P3I,1P3O,1P3P,1U35,2CV5,3AFA,3AV2,3AZI,3AZJ,3AZK,3AZL,3AZM,3AZN,3W96,3W97,3W98,3W99,3WA9,3WAA,3WKJ,3WTP,3X1S,3X1T,3X1U,3X1V,4HGA,4KUD,4YM5,4YM6,4Z2M,5AV5,5AV6,5AV8,5AV9,5AVB,5AVC,5B1M,5B24,5B2I,5B2J,5B31,5B32,5B33,5C3I,5CPI,5CPJ,5CPK,5GSE,5GSU,5GT0,5GT3,5GTC,5JRG,5ONG,5ONW,5X7X,5XF3,5XF4,5XF5,5XM0,5Y0C,5Y0D,5Z30,5ZBA,5ZBB,6A5L,6A5O,6A5P,6A5R,6A5T,6A5U,6HKT,6HTS,6INQ,6IPU,6IQ4,6IR9,6J4W,6J4X,6J4Y,6J4Z,6J50,6J51,6JOU,6JR0,6JR1,6JXD,6K1I,6K1J,6K1K,6KE9,6KVD,6L49,6L4A,6L9H,6L9Z,6LA2,6LA8,6LA9,6LAB,6LE9,6LER,6LTJ,6M3V,6M44,6M4D,6M4G,6M4H,6R0C,6R8Y,6R8Z,6R90,6R91,6R92,6R93,6R94,6RNY,6T90,6T93,6UPK,6UPL,6USJ,6V2K,6V92,6YOV,7BWD,7C0M,7CCQ,7CCR,7COW,7D1Z,7DBP,7K5X,7K5Y,7K60,7K61,7K63,7K7G,7LYA,7LYB,7LYC,7NL0,7SCY,7SCZ,7U0G,7U0I,7U0J,7UD5,7UX9,7V6Q,7V90,7V96,7V9C,7V9J,7V9K,7V9S,7VA4,7VZ4,7W9V,7WBV,7WBW,7WBX,7X57,7X58,7XD1,7XSE,7XSX,7XSZ,7XT7,7XTD,7XTI,7XVL,7XVM,7XX5,7XX6,7XX7,7XZX,7XZY,7XZZ,7Y00,7Y5U,7Y5V,7Y5W,7Y60,7Y61,7Y8R,7YOZ,7YQK,7Z0O,7ZI4,8DK5,8DU4,8GRM,8H0V,8H0W,8H1T,8HAG,8HAH,8HAI,8HAJ,8HAK,8HAL,8HAM,8HAN,8IQF,8IQG,8J6S,8J6T,8OO7,8OOA,8OOP,8OOS,8OSJ,8OSK,8OSL,8OTS,8OTT,8PEP,8SPS,8SPU	Histone H3.1	H31_HUMAN	P68431	A0PJT7 A5PLR1 P02295 P02296 P16106 Q6ISV8 Q6NWP8 Q6NWP9 Q6NXU4 Q71DJ3 Q93081						
668504	ONC(=O)\C=C\c1ccc2n(CCN3CCCCC3)c(CCc3ccccc3)nc2c1	InChI=1S/C25H30N4O2/c30-25(27-31)14-11-21-9-12-23-22(19-21)26-24(13-10-20-7-3-1-4-8-20)29(23)18-17-28-15-5-2-6-16-28/h1,3-4,7-9,11-12,14,19,31H,2,5-6,10,13,15-18H2,(H,27,30)/b14-11+	XZWCFUZJOAZGAI-SDNWHVSQSA-N	50248522	CHEMBL489332::N-hydroxy-3-(2-phenethyl-1-(2-(piperidin-1-yl)ethyl)-1H-benzo[d]imidazol-5-yl)acrylamide::US10201527, Compound 67::US10736881, Compound 67::US8551988, 67	Histone H3.1					 500					US Patent		10.7270/Q2PK0J7F		aid1797115	US10201527	Chen, D; Song, HY; Sun, ET; Yu, N; Zou, Y	Mei Pharma Inc	http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50248522	http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=557&target=Histone+H3.1&column=ki&startPg=0&Increment=50&submit=Search	http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50248522&enzyme=Histone+H3.1&column=ki&startPg=0&Increment=50&submit=Search			6918846	104103167		CHEMBL489332				ZINC13981299	1	MARTKQTARKSTGGKAPRKQLATKAARKSAPATGGVKKPHRYRPGTVALREIRRYQKSTELLIRKLPFQRLVREIAQDFKTDLRFQSSAVMALQEACEAYLVGLFEDTNLCAIHAKRVTIMPKDIQLARRIRGERA	1P3B,1P3F,1P3G,1P3I,1P3O,1P3P,1U35,2CV5,3AFA,3AV2,3AZI,3AZJ,3AZK,3AZL,3AZM,3AZN,3W96,3W97,3W98,3W99,3WA9,3WAA,3WKJ,3WTP,3X1S,3X1T,3X1U,3X1V,4HGA,4KUD,4YM5,4YM6,4Z2M,5AV5,5AV6,5AV8,5AV9,5AVB,5AVC,5B1M,5B24,5B2I,5B2J,5B31,5B32,5B33,5C3I,5CPI,5CPJ,5CPK,5GSE,5GSU,5GT0,5GT3,5GTC,5JRG,5ONG,5ONW,5X7X,5XF3,5XF4,5XF5,5XM0,5Y0C,5Y0D,5Z30,5ZBA,5ZBB,6A5L,6A5O,6A5P,6A5R,6A5T,6A5U,6HKT,6HTS,6INQ,6IPU,6IQ4,6IR9,6J4W,6J4X,6J4Y,6J4Z,6J50,6J51,6JOU,6JR0,6JR1,6JXD,6K1I,6K1J,6K1K,6KE9,6KVD,6L49,6L4A,6L9H,6L9Z,6LA2,6LA8,6LA9,6LAB,6LE9,6LER,6LTJ,6M3V,6M44,6M4D,6M4G,6M4H,6R0C,6R8Y,6R8Z,6R90,6R91,6R92,6R93,6R94,6RNY,6T90,6T93,6UPK,6UPL,6USJ,6V2K,6V92,6YOV,7BWD,7C0M,7CCQ,7CCR,7COW,7D1Z,7DBP,7K5X,7K5Y,7K60,7K61,7K63,7K7G,7LYA,7LYB,7LYC,7NL0,7SCY,7SCZ,7U0G,7U0I,7U0J,7UD5,7UX9,7V6Q,7V90,7V96,7V9C,7V9J,7V9K,7V9S,7VA4,7VZ4,7W9V,7WBV,7WBW,7WBX,7X57,7X58,7XD1,7XSE,7XSX,7XSZ,7XT7,7XTD,7XTI,7XVL,7XVM,7XX5,7XX6,7XX7,7XZX,7XZY,7XZZ,7Y00,7Y5U,7Y5V,7Y5W,7Y60,7Y61,7Y8R,7YOZ,7YQK,7Z0O,7ZI4,8DK5,8DU4,8GRM,8H0V,8H0W,8H1T,8HAG,8HAH,8HAI,8HAJ,8HAK,8HAL,8HAM,8HAN,8IQF,8IQG,8J6S,8J6T,8OO7,8OOA,8OOP,8OOS,8OSJ,8OSK,8OSL,8OTS,8OTT,8PEP,8SPS,8SPU	Histone H3.1	H31_HUMAN	P68431	A0PJT7 A5PLR1 P02295 P02296 P16106 Q6ISV8 Q6NWP8 Q6NWP9 Q6NXU4 Q71DJ3 Q93081