Compile Data Set for Download or QSAR

Found 160 hits with Last Name = 'romero' and Initial = 'af'   

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
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311486 (CHEM-US-00192 | US10155764, Example 65B) Show SMILES C[C@@H](Nc1nn(C)c(=O)c2cccnc12)[C@H](N(C)C)c1ccccc1 |r| Show InChI InChI=1S/C19H23N5O/c1-13(17(23(2)3)14-9-6-5-7-10-14)21-18-16-15(11-8-12-20-16)19(25)24(4)22-18/h5-13,17H,1-4H3,(H,21,22)/t13-,17+/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	19	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311498 (CHEM-US-00210 | US10155764, Example 74A) Show SMILES C[C@H](Nc1nn(C)c(=O)c2cccnc12)[C@@H](N(C)C)c1ccc(cc1)S(=O)(=O)c1ccccc1 |r| Show InChI InChI=1S/C25H27N5O3S/c1-17(27-24-22-21(11-8-16-26-22)25(31)30(4)28-24)23(29(2)3)18-12-14-20(15-13-18)34(32,33)19-9-6-5-7-10-19/h5-17,23H,1-4H3,(H,27,28)/t17-,23+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Bromodomain-containing protein 9 [134-239] (Homo sapiens (Human))	BDBM310899 (4-[4-(1-hydroxy-1-methyl-ethyl)phenyl]-6-methyl-1H...) Show SMILES Cn1cc(-c2ccc(cc2)C(C)(C)O)c2cc[nH]c2c1=O Show InChI InChI=1S/C17H18N2O2/c1-17(2,21)12-6-4-11(5-7-12)14-10-19(3)16(20)15-13(14)8-9-18-15/h4-10,18,21H,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
Genentech, Inc.; Constellation Pharmaceuticals Inc. US Patent					Assay Description His/Flag epitope tagged BRD9134-239 was cloned, expressed, and purified to homogeneity. BRD9 binding and inhibition was assessed by monitoring the en...				US Patent US10150767 (2018) BindingDB Entry DOI: 10.7270/Q2V98B5W
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311480 (CHEM-US-00186 | US10155764, Example 60) Show SMILES C[C@H](Nc1nn(C)c(=O)c2ccccc12)[C@@H](N(C)C)c1ccccn1 |r| Show InChI InChI=1S/C19H23N5O/c1-13(17(23(2)3)16-11-7-8-12-20-16)21-18-14-9-5-6-10-15(14)19(25)24(4)22-18/h5-13,17H,1-4H3,(H,21,22)/t13-,17+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311495 (CHEM-US-00207 | US10155764, Example 73A) Show SMILES C[C@H](Nc1nn(C)c(=O)c2ccccc12)[C@@H](N(C)C)c1ccccc1 |r| Show InChI InChI=1S/C20H24N4O/c1-14(18(23(2)3)15-10-6-5-7-11-15)21-19-16-12-8-9-13-17(16)20(25)24(4)22-19/h5-14,18H,1-4H3,(H,21,22)/t14-,18+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	23	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Bromodomain-containing protein 9 [134-239] (Homo sapiens (Human))	BDBM310892 (N-(2-methoxyethyl)-4-(6-methyl-7-oxo-1H-pyrrolo[2,...) Show SMILES COCCNC(=O)c1ccc(cc1)-c1cn(C)c(=O)c2[nH]ccc12 Show InChI InChI=1S/C18H19N3O3/c1-21-11-15(14-7-8-19-16(14)18(21)23)12-3-5-13(6-4-12)17(22)20-9-10-24-2/h3-8,11,19H,9-10H2,1-2H3,(H,20,22)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	24	n/a	n/a	n/a	n/a	n/a	n/a
Genentech, Inc.; Constellation Pharmaceuticals Inc. US Patent					Assay Description His/Flag epitope tagged BRD9134-239 was cloned, expressed, and purified to homogeneity. BRD9 binding and inhibition was assessed by monitoring the en...				US Patent US10150767 (2018) BindingDB Entry DOI: 10.7270/Q2V98B5W
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311483 (CHEM-US-00189 | US10155764, Example 63) Show SMILES C[C@H](Nc1nn(C)c(=O)c2ccccc12)[C@@H](N(C)C)c1ccc(Oc2ccccc2)cc1 |r| Show InChI InChI=1S/C26H28N4O2/c1-18(27-25-22-12-8-9-13-23(22)26(31)30(4)28-25)24(29(2)3)19-14-16-21(17-15-19)32-20-10-6-5-7-11-20/h5-18,24H,1-4H3,(H,27,28)/t18-,24+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	25	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Bromodomain-containing protein 9 [134-239] (Homo sapiens (Human))	BDBM310896 (7-(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridin-4-yl)-1...) Show SMILES Cn1cc(-c2ccc3NC(=O)CCNc3c2)c2cc[nH]c2c1=O Show InChI InChI=1S/C17H16N4O2/c1-21-9-12(11-4-6-19-16(11)17(21)23)10-2-3-13-14(8-10)18-7-5-15(22)20-13/h2-4,6,8-9,18-19H,5,7H2,1H3,(H,20,22)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	25	n/a	n/a	n/a	n/a	n/a	n/a
Genentech, Inc.; Constellation Pharmaceuticals Inc. US Patent					Assay Description His/Flag epitope tagged BRD9134-239 was cloned, expressed, and purified to homogeneity. BRD9 binding and inhibition was assessed by monitoring the en...				US Patent US10150767 (2018) BindingDB Entry DOI: 10.7270/Q2V98B5W
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311512 (CHEM-US-00232 | US10155764, Example 87) Show SMILES C[C@H](Nc1nn(C)c(=O)c2cccnc12)[C@@H](N(C)C)c1ccc(cc1)C(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C27H29N5O3/c1-18(29-25-23-22(11-8-16-28-23)26(33)32(4)30-25)24(31(2)3)20-12-14-21(15-13-20)27(34)35-17-19-9-6-5-7-10-19/h5-16,18,24H,17H2,1-4H3,(H,29,30)/t18-,24+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	29	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311511 (US10155764, Example 86) Show SMILES CC(C)OC(=O)c1ccc(cc1)[C@@H]([C@H](C)Nc1nn(C)c(=O)c2cccnc12)N(C)C |r| Show InChI InChI=1S/C23H29N5O3/c1-14(2)31-23(30)17-11-9-16(10-12-17)20(27(4)5)15(3)25-21-19-18(8-7-13-24-19)22(29)28(6)26-21/h7-15,20H,1-6H3,(H,25,26)/t15-,20+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Bromodomain-containing protein 9 [134-239] (Homo sapiens (Human))	BDBM310895 (3-methyl-7-(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridi...) Show SMILES CC1CNc2cc(ccc2NC1=O)-c1cn(C)c(=O)c2[nH]ccc12 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	31	n/a	n/a	n/a	n/a	n/a	n/a
Genentech, Inc.; Constellation Pharmaceuticals Inc. US Patent					Assay Description His/Flag epitope tagged BRD9134-239 was cloned, expressed, and purified to homogeneity. BRD9 binding and inhibition was assessed by monitoring the en...				US Patent US10150767 (2018) BindingDB Entry DOI: 10.7270/Q2V98B5W
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311479 (CHEM-US-00185 | US10155764, Example 59) Show SMILES CC(C)Oc1ccc(cc1)[C@@H]([C@H](C)Nc1nn(C)c(=O)c2ccccc12)N(C)C |r| Show InChI InChI=1S/C23H30N4O2/c1-15(2)29-18-13-11-17(12-14-18)21(26(4)5)16(3)24-22-19-9-7-8-10-20(19)23(28)27(6)25-22/h7-16,21H,1-6H3,(H,24,25)/t16-,21+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	33	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Chromatin remodeling regulator CECR2 [424-538] (Homo sapiens (Human))	BDBM310905 (2-methyl-7-(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridi...) Show SMILES CC1Oc2cc(ccc2NC1=O)-c1cn(C)c(=O)c2[nH]ccc12 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	36	n/a	n/a	n/a	n/a	n/a	n/a
Genentech, Inc.; Constellation Pharmaceuticals Inc. US Patent					Assay Description His/Flag epitope tagged CECR2424-538 was cloned, expressed, and purified to homogeneity. CECR2 binding and inhibition was assessed by monitoring the ...				US Patent US10150767 (2018) BindingDB Entry DOI: 10.7270/Q2V98B5W
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311502 (US10155764, Example 77) Show SMILES C[C@H](Nc1nn(C)c(=O)c2ccccc12)[C@@H](N(C)C)c1ccc(OCc2ccccc2)cc1 |r| Show InChI InChI=1S/C27H30N4O2/c1-19(28-26-23-12-8-9-13-24(23)27(32)31(4)29-26)25(30(2)3)21-14-16-22(17-15-21)33-18-20-10-6-5-7-11-20/h5-17,19,25H,18H2,1-4H3,(H,28,29)/t19-,25+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	36	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311490 (CHEM-US-00202 | US10155764, Example 70A) Show SMILES C[C@H](Nc1nn(C)c(=O)c2cccc(C)c12)[C@@H](N(C)C)c1ccccc1 |r| Show InChI InChI=1S/C21H26N4O/c1-14-10-9-13-17-18(14)20(23-25(5)21(17)26)22-15(2)19(24(3)4)16-11-7-6-8-12-16/h6-13,15,19H,1-5H3,(H,22,23)/t15-,19+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	36	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311478 (CHEM-US-00184 | US10155764, Example 58) Show SMILES CC[C@H](Nc1nn(C)c(=O)c2cccnc12)[C@@H](N(C)C)c1ccccc1 |r| Show InChI InChI=1S/C20H25N5O/c1-5-16(18(24(2)3)14-10-7-6-8-11-14)22-19-17-15(12-9-13-21-17)20(26)25(4)23-19/h6-13,16,18H,5H2,1-4H3,(H,22,23)/t16-,18-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311448 (CHEM-US-00145 | US10155764, Example 34) Show SMILES CN(C)[C@H]1CN(CC[C@@H]1Nc1nn(C)c(=O)c2ccccc12)c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C22H26ClN5O/c1-26(2)20-14-28(16-10-8-15(23)9-11-16)13-12-19(20)24-21-17-6-4-5-7-18(17)22(29)27(3)25-21/h4-11,19-20H,12-14H2,1-3H3,(H,24,25)/t19-,20-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311497 (CHEM-US-00209 | US10155764, Example 74) Show SMILES CC(Nc1nn(C)c(=O)c2cccnc12)C(N(C)C)c1ccc(cc1)S(=O)(=O)c1ccccc1 Show InChI InChI=1S/C25H27N5O3S/c1-17(27-24-22-21(11-8-16-26-22)25(31)30(4)28-24)23(29(2)3)18-12-14-20(15-13-18)34(32,33)19-9-6-5-7-10-19/h5-17,23H,1-4H3,(H,27,28)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311476 (CHEM-US-00182 | US10155764, Example 56) Show SMILES CC[C@H](Nc1nn(C)c(=O)c2ccccc12)[C@@H](N(C)C)c1ccccc1 |r| Show InChI InChI=1S/C21H26N4O/c1-5-18(19(24(2)3)15-11-7-6-8-12-15)22-20-16-13-9-10-14-17(16)21(26)25(4)23-20/h6-14,18-19H,5H2,1-4H3,(H,22,23)/t18-,19-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	41	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311412 (US10155764, Example 8A) Show SMILES C[C@@H](CN(C)C)Nc1nn(C)c(=O)c2cccnc12 |r| Show InChI InChI=1S/C13H19N5O/c1-9(8-17(2)3)15-12-11-10(6-5-7-14-11)13(19)18(4)16-12/h5-7,9H,8H2,1-4H3,(H,15,16)/t9-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	42	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311501 (US10155764, Example 76) Show SMILES C[C@H](Nc1nn(C)c(=O)c2ccccc12)[C@@H](N(C)C)c1ccc(O)cc1 |r| Show InChI InChI=1S/C20H24N4O2/c1-13(18(23(2)3)14-9-11-15(25)12-10-14)21-19-16-7-5-6-8-17(16)20(26)24(4)22-19/h5-13,18,25H,1-4H3,(H,21,22)/t13-,18+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	42	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311503 (CHEM-US-00222 | US10155764, Example 78) Show SMILES C[C@H](Nc1nn(C)c(=O)c2ccccc12)[C@@H](N(C)C)c1ccc(OCC2CC2)cc1 |r| Show InChI InChI=1S/C24H30N4O2/c1-16(25-23-20-7-5-6-8-21(20)24(29)28(4)26-23)22(27(2)3)18-11-13-19(14-12-18)30-15-17-9-10-17/h5-8,11-14,16-17,22H,9-10,15H2,1-4H3,(H,25,26)/t16-,22+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	44	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311403 (US10155764, Example 1A) Show SMILES CN(C)[C@H](CNc1nn(C)c(=O)c2cccnc12)c1ccccc1 |r| Show InChI InChI=1S/C18H21N5O/c1-22(2)15(13-8-5-4-6-9-13)12-20-17-16-14(10-7-11-19-16)18(24)23(3)21-17/h4-11,15H,12H2,1-3H3,(H,20,21)/t15-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	45	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311472 (CHEM-US-00174 | US10155764, Example 54 | US1015576...) Show SMILES CN(C)[C@H]1CCCC[C@H]1Nc1nn(C)c(=O)c2ccccc12 |r| Show InChI InChI=1S/C17H24N4O/c1-20(2)15-11-7-6-10-14(15)18-16-12-8-4-5-9-13(12)17(22)21(3)19-16/h4-5,8-9,14-15H,6-7,10-11H2,1-3H3,(H,18,19)/t14-,15+/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	45	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311505 (CHEM-US-00224 | US10155764, Example 80) Show SMILES C[C@H](Nc1nn(C)c(=O)c2ccccc12)[C@@H](N(C)C)c1ccc(Oc2ccccn2)cc1 |r| Show InChI InChI=1S/C25H27N5O2/c1-17(27-24-20-9-5-6-10-21(20)25(31)30(4)28-24)23(29(2)3)18-12-14-19(15-13-18)32-22-11-7-8-16-26-22/h5-17,23H,1-4H3,(H,27,28)/t17-,23+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	46	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311433 (CHEM-US-00130 | US10155764, Example 22A) Show SMILES CN(C)[C@H](CNc1nn(C)c(=O)c2ccccc12)c1ccccc1 |r| Show InChI InChI=1S/C19H22N4O/c1-22(2)17(14-9-5-4-6-10-14)13-20-18-15-11-7-8-12-16(15)19(24)23(3)21-18/h4-12,17H,13H2,1-3H3,(H,20,21)/t17-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	47	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311510 (CHEM-US-00230 | US10155764, Example 85) Show SMILES CNC(=O)c1ccc(cc1)[C@@H]([C@H](C)Nc1nn(C)c(=O)c2cccnc12)N(C)C |r| Show InChI InChI=1S/C21H26N6O2/c1-13(18(26(3)4)14-8-10-15(11-9-14)20(28)22-2)24-19-17-16(7-6-12-23-17)21(29)27(5)25-19/h6-13,18H,1-5H3,(H,22,28)(H,24,25)/t13-,18+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 [42-168] (Homo sapiens (Human))	BDBM310889 (4-(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridin-4-yl)-N...) Show SMILES Cn1cc(-c2ccc(cc2)C(=O)Nc2cccnc2)c2cc[nH]c2c1=O Show InChI InChI=1S/C20H16N4O2/c1-24-12-17(16-8-10-22-18(16)20(24)26)13-4-6-14(7-5-13)19(25)23-15-3-2-9-21-11-15/h2-12,22H,1H3,(H,23,25)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	51	n/a	n/a	n/a	n/a	n/a	n/a
Genentech, Inc.; Constellation Pharmaceuticals Inc. US Patent					Assay Description His/Flag epitope tagged BRD4 BD142-168 was cloned, expressed, and purified to. BRD4 binding and inhibition was assessed by monitoring the engagement ...				US Patent US10150767 (2018) BindingDB Entry DOI: 10.7270/Q2V98B5W
					More data for this Ligand-Target Pair
Bromodomain-containing protein 9 [134-239] (Homo sapiens (Human))	BDBM310898 (N,N-dimethyl-3-(6-methyl-7-oxo-1H-pyrrolo[2,3-c]py...) Show SMILES CN(C)C(=O)c1cccc(c1)-c1cn(C)c(=O)c2[nH]ccc12 Show InChI InChI=1S/C17H17N3O2/c1-19(2)16(21)12-6-4-5-11(9-12)14-10-20(3)17(22)15-13(14)7-8-18-15/h4-10,18H,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB US Patent	n/a	n/a	53	n/a	n/a	n/a	n/a	n/a	n/a
Genentech, Inc.; Constellation Pharmaceuticals Inc. US Patent					Assay Description His/Flag epitope tagged BRD9134-239 was cloned, expressed, and purified to homogeneity. BRD9 binding and inhibition was assessed by monitoring the en...				US Patent US10150767 (2018) BindingDB Entry DOI: 10.7270/Q2V98B5W
					More data for this Ligand-Target Pair				3D Structure (crystal)
Bromodomain-containing protein 9 [134-239] (Homo sapiens (Human))	BDBM310902 (6-methyl-4-[4-(1-methyl-4-piperidyl)phenyl]-1H-pyr...) Show SMILES CN1CCC(CC1)c1ccc(cc1)-c1cn(C)c(=O)c2[nH]ccc12 Show InChI InChI=1S/C20H23N3O/c1-22-11-8-15(9-12-22)14-3-5-16(6-4-14)18-13-23(2)20(24)19-17(18)7-10-21-19/h3-7,10,13,15,21H,8-9,11-12H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	53	n/a	n/a	n/a	n/a	n/a	n/a
Genentech, Inc.; Constellation Pharmaceuticals Inc. US Patent					Assay Description His/Flag epitope tagged BRD9134-239 was cloned, expressed, and purified to homogeneity. BRD9 binding and inhibition was assessed by monitoring the en...				US Patent US10150767 (2018) BindingDB Entry DOI: 10.7270/Q2V98B5W
					More data for this Ligand-Target Pair
Chromatin remodeling regulator CECR2 [424-538] (Homo sapiens (Human))	BDBM310911 (6-methyl-4-(2-methyl-3,4-dihydro-1H-isoquinolin-6-...) Show SMILES Cn1cc(-c2ccc3CNCCc3c2)c2cc[nH]c2c1=O Show InChI InChI=1S/C17H17N3O/c1-20-10-15(14-5-7-19-16(14)17(20)21)12-2-3-13-9-18-6-4-11(13)8-12/h2-3,5,7-8,10,18-19H,4,6,9H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	54	n/a	n/a	n/a	n/a	n/a	n/a
Genentech, Inc.; Constellation Pharmaceuticals Inc. US Patent					Assay Description His/Flag epitope tagged CECR2424-538 was cloned, expressed, and purified to homogeneity. CECR2 binding and inhibition was assessed by monitoring the ...				US Patent US10150767 (2018) BindingDB Entry DOI: 10.7270/Q2V98B5W
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311509 (CHEM-US-00229 | US10155764, Example 84) Show SMILES C[C@H](Nc1nn(C)c(=O)c2cccnc12)[C@@H](N(C)C)c1ccc(cc1)C(=O)N(C)Cc1ccccc1 |r| Show InChI InChI=1S/C28H32N6O2/c1-19(30-26-24-23(12-9-17-29-24)28(36)34(5)31-26)25(32(2)3)21-13-15-22(16-14-21)27(35)33(4)18-20-10-7-6-8-11-20/h6-17,19,25H,18H2,1-5H3,(H,30,31)/t19-,25+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	56	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311424 (US10155764, Example 16A) Show SMILES CN(C)[C@H]1CCC[C@H]1Nc1nn(C)c(=O)c2cccnc12 |r| Show InChI InChI=1S/C15H21N5O/c1-19(2)12-8-4-7-11(12)17-14-13-10(6-5-9-16-13)15(21)20(3)18-14/h5-6,9,11-12H,4,7-8H2,1-3H3,(H,17,18)/t11-,12+/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	57	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 [42-168] (Homo sapiens (Human))	BDBM310880 (7-(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridin-4-yl)-4...) Show SMILES Cn1cc(-c2ccc3NC(=O)CC(Nc3c2)c2cccs2)c2cc[nH]c2c1=O Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	58	n/a	n/a	n/a	n/a	n/a	n/a
Genentech, Inc.; Constellation Pharmaceuticals Inc. US Patent					Assay Description His/Flag epitope tagged BRD4 BD142-168 was cloned, expressed, and purified to. BRD4 binding and inhibition was assessed by monitoring the engagement ...				US Patent US10150767 (2018) BindingDB Entry DOI: 10.7270/Q2V98B5W
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311507 (US10155764, Example 82) Show SMILES C[C@H](Nc1nn(C)c(=O)c2cccnc12)[C@@H](N(C)C)c1ccc(cc1)C(=O)N1CCOCC1 |r| Show InChI InChI=1S/C24H30N6O3/c1-16(26-22-20-19(6-5-11-25-20)24(32)29(4)27-22)21(28(2)3)17-7-9-18(10-8-17)23(31)30-12-14-33-15-13-30/h5-11,16,21H,12-15H2,1-4H3,(H,26,27)/t16-,21+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	59	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311475 (US10155764, Example 55) Show SMILES C[C@H](Nc1nn(C)c(=O)c2ccccc12)[C@@H](N(C)C)c1ccc(cc1)S(=O)(=O)c1ccccc1 |r| Show InChI InChI=1S/C26H28N4O3S/c1-18(27-25-22-12-8-9-13-23(22)26(31)30(4)28-25)24(29(2)3)19-14-16-21(17-15-19)34(32,33)20-10-6-5-7-11-20/h5-18,24H,1-4H3,(H,27,28)/t18-,24+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	61	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Transcription initiation factor TFIID subunit 1 [1504-1635] (Homo sapiens (Human))	BDBM310915 (N-benzyl-4-(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridi...) Show SMILES Cn1cc(-c2cccc(c2)C(=O)NCc2ccccc2)c2cc[nH]c2c1=O Show InChI InChI=1S/C22H19N3O2/c1-25-14-19(18-10-11-23-20(18)22(25)27)16-8-5-9-17(12-16)21(26)24-13-15-6-3-2-4-7-15/h2-12,14,23H,13H2,1H3,(H,24,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	63	n/a	n/a	n/a	n/a	n/a	n/a
Genentech, Inc.; Constellation Pharmaceuticals Inc. US Patent					Assay Description His/Flag epitope tagged TAF1-BD21504-1635 was cloned, expressed, and purified to homogeneity. TAF1-BD2 binding and inhibition was assessed by monitor...				US Patent US10150767 (2018) BindingDB Entry DOI: 10.7270/Q2V98B5W
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311482 (CHEM-US-00188 | US10155764, Example 62) Show SMILES COc1ccc(cn1)[C@@H]([C@H](C)Nc1nn(C)c(=O)c2ccccc12)N(C)C |r| Show InChI InChI=1S/C20H25N5O2/c1-13(18(24(2)3)14-10-11-17(27-5)21-12-14)22-19-15-8-6-7-9-16(15)20(26)25(4)23-19/h6-13,18H,1-5H3,(H,22,23)/t13-,18+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	63	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Bromodomain-containing protein 9 [134-239] (Homo sapiens (Human))	BDBM310903 (6-methyl-4-[4-[(1-methyl-4-piperidyl)methyl]phenyl...) Show SMILES CN1CCC(Cc2ccc(cc2)-c2cn(C)c(=O)c3[nH]ccc23)CC1 Show InChI InChI=1S/C21H25N3O/c1-23-11-8-16(9-12-23)13-15-3-5-17(6-4-15)19-14-24(2)21(25)20-18(19)7-10-22-20/h3-7,10,14,16,22H,8-9,11-13H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	64	n/a	n/a	n/a	n/a	n/a	n/a
Genentech, Inc.; Constellation Pharmaceuticals Inc. US Patent					Assay Description His/Flag epitope tagged BRD9134-239 was cloned, expressed, and purified to homogeneity. BRD9 binding and inhibition was assessed by monitoring the en...				US Patent US10150767 (2018) BindingDB Entry DOI: 10.7270/Q2V98B5W
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311431 (CHEM-US-00128 | US10155764, Example 21) Show SMILES COc1ccc(cc1)C(CNc1nn(C)c(=O)c2ccccc12)N(C)C Show InChI InChI=1S/C20H24N4O2/c1-23(2)18(14-9-11-15(26-4)12-10-14)13-21-19-16-7-5-6-8-17(16)20(25)24(3)22-19/h5-12,18H,13H2,1-4H3,(H,21,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	64	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311440 (CHEM-US-00137 | US10155764, Example 28) Show SMILES CC(CN(C)C)Nc1nn(C)c(=O)c2ccccc12 Show InChI InChI=1S/C14H20N4O/c1-10(9-17(2)3)15-13-11-7-5-6-8-12(11)14(19)18(4)16-13/h5-8,10H,9H2,1-4H3,(H,15,16)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	66	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311444 (CHEM-US-00141 | US10155764, Example 32 | US1015576...) Show SMILES CN(C)C1CN(CCC1Nc1nn(C)c(=O)c2cccnc12)c1ccc(Cl)cc1 Show InChI InChI=1S/C21H25ClN6O/c1-26(2)18-13-28(15-8-6-14(22)7-9-15)12-10-17(18)24-20-19-16(5-4-11-23-19)21(29)27(3)25-20/h4-9,11,17-18H,10,12-13H2,1-3H3,(H,24,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	69	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311508 (CHEM-US-00228 | US10155764, Example 83) Show SMILES C[C@H](Nc1nn(C)c(=O)c2cccnc12)[C@@H](N(C)C)c1ccc(cc1)C(=O)N1CCCC1 |r| Show InChI InChI=1S/C24H30N6O2/c1-16(26-22-20-19(8-7-13-25-20)24(32)29(4)27-22)21(28(2)3)17-9-11-18(12-10-17)23(31)30-14-5-6-15-30/h7-13,16,21H,5-6,14-15H2,1-4H3,(H,26,27)/t16-,21+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	71	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311411 (US10155764, Example 7B) Show SMILES C[C@H](CNc1nn(C)c(=O)c2cccnc12)N(C)C |r| Show InChI InChI=1S/C13H19N5O/c1-9(17(2)3)8-15-12-11-10(6-5-7-14-11)13(19)18(4)16-12/h5-7,9H,8H2,1-4H3,(H,15,16)/t9-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	72	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311504 (CHEM-US-00223 | US10155764, Example 79) Show SMILES COc1ccc(cc1)[C@@H]([C@H](C)Nc1nn(C)c(=O)c2ccccc12)N(C)C |r| Show InChI InChI=1S/C21H26N4O2/c1-14(19(24(2)3)15-10-12-16(27-5)13-11-15)22-20-17-8-6-7-9-18(17)21(26)25(4)23-20/h6-14,19H,1-5H3,(H,22,23)/t14-,19+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	73	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Chromatin remodeling regulator CECR2 [424-538] (Homo sapiens (Human))	BDBM310910 (4-(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridin-4-yl)-N...) Show SMILES Cn1cc(-c2ccc(cc2)C(=O)Nc2ccccc2)c2cc[nH]c2c1=O Show InChI InChI=1S/C21H17N3O2/c1-24-13-18(17-11-12-22-19(17)21(24)26)14-7-9-15(10-8-14)20(25)23-16-5-3-2-4-6-16/h2-13,22H,1H3,(H,23,25)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	75	n/a	n/a	n/a	n/a	n/a	n/a
Genentech, Inc.; Constellation Pharmaceuticals Inc. US Patent					Assay Description His/Flag epitope tagged CECR2424-538 was cloned, expressed, and purified to homogeneity. CECR2 binding and inhibition was assessed by monitoring the ...				US Patent US10150767 (2018) BindingDB Entry DOI: 10.7270/Q2V98B5W
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311477 (CHEM-US-00183 | US10155764, Example 57) Show SMILES C[C@H](Nc1nn(C)c(=O)c2ccccc12)[C@@H](N(C)C)c1cnn(c1)-c1ccccc1 |r| Show InChI InChI=1S/C23H26N6O/c1-16(25-22-19-12-8-9-13-20(19)23(30)28(4)26-22)21(27(2)3)17-14-24-29(15-17)18-10-6-5-7-11-18/h5-16,21H,1-4H3,(H,25,26)/t16-,21+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	75	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311422 (US10155764, Example 15A) Show SMILES CN(C)[C@H]1CCCC[C@H]1Nc1nn(C)c(=O)c2cccnc12 |r| Show InChI InChI=1S/C16H23N5O/c1-20(2)13-9-5-4-8-12(13)18-15-14-11(7-6-10-17-14)16(22)21(3)19-15/h6-7,10,12-13H,4-5,8-9H2,1-3H3,(H,18,19)/t12-,13+/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	78	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT2B [719-832] (Homo sapiens (Human))	BDBM311513 (US10155764, Example 88) Show SMILES C[C@H](Nc1nn(C)c(=O)c2ccccc12)[C@@H](N(C)C)c1ccc(=O)[nH]c1 |r| Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	80	n/a	n/a	n/a	n/a	n/a	n/a
GENENTECH, INC; CONSTELLATION PHARMACEUTICALS, INC. US Patent					Assay Description His/Flag epitope tagged PCAF719-832 bromodomain was cloned, expressed and purified to homogeneity in-house. PCAF bromodomain binding and inhibition o...				US Patent US10155764 (2018) BindingDB Entry DOI: 10.7270/Q25M67T9
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 [42-168] (Homo sapiens (Human))	BDBM310879 (2-(6-methyl-7-oxo-1H-pyrrolo[2,3-c]pyridin-4-yl)-5...) Show SMILES Cn1cc(C2CC3C=CNN3C3C(CCCC3=O)N2)c2cc[nH]c2c1=O |c:7| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	81	n/a	n/a	n/a	n/a	n/a	n/a
Genentech, Inc.; Constellation Pharmaceuticals Inc. US Patent					Assay Description His/Flag epitope tagged BRD4 BD142-168 was cloned, expressed, and purified to. BRD4 binding and inhibition was assessed by monitoring the engagement ...				US Patent US10150767 (2018) BindingDB Entry DOI: 10.7270/Q2V98B5W
					More data for this Ligand-Target Pair

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