Found 2 hits for monomerid = 50445038 Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
Histone acetyltransferase KAT2B
(Homo sapiens (Human)) | BDBM50445038
(CHEMBL3098705)Show SMILES [#6]-[#6@@H](-[#8])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6])-[#7]-[#6](-[#6])=O)-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-n1cc(-[#6]-[#16]-[#6]-[#6]-[#7]-[#6](=O)-[#6]-[#6]-[#7]-[#6](=O)-[#6@@H](-[#8])C([#6])([#6])[#6]-[#8]P([#8])(=O)[#8]P([#8])(=O)[#8]-[#6]-[#6@H]-2-[#8]-[#6@H](-[#6@H](-[#8])-[#6@@H]-2-[#8]P([#8])([#8])=O)-n2cnc3c(-[#7])ncnc23)nn1)-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@H]-1-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](-[#7])=O |r| Show InChI InChI=1S/C78H136N31O31P3S/c1-41(96-44(4)112)65(119)100-49(19-13-25-89-76(83)84)68(122)101-48(17-8-11-24-80)69(123)103-51(35-110)70(124)104-57(43(3)111)72(126)92-32-55(114)91-33-56(115)98-47(66(120)97-42(2)74(128)108-30-15-21-52(108)71(125)102-50(20-14-26-90-77(85)86)67(121)99-46(63(82)118)16-7-10-23-79)18-9-12-29-107-34-45(105-106-107)37-144-31-28-87-54(113)22-27-88-73(127)61(117)78(5,6)38-137-143(134,135)140-142(132,133)136-36-53-60(139-141(129,130)131)59(116)75(138-53)109-40-95-58-62(81)93-39-94-64(58)109/h34,39-43,46-53,57,59-61,75,110-111,116-117H,7-33,35-38,79-80H2,1-6H3,(H2,82,118)(H,87,113)(H,88,127)(H,91,114)(H,92,126)(H,96,112)(H,97,120)(H,98,115)(H,99,121)(H,100,119)(H,101,122)(H,102,125)(H,103,123)(H,104,124)(H,132,133)(H,134,135)(H2,81,93,94)(H4,83,84,89)(H4,85,86,90)(H2,129,130,131)/t41-,42-,43+,46-,47-,48-,49-,50-,51-,52-,53+,57-,59+,60+,61+,75+/m0/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Utrecht University
Curated by ChEMBL
| Assay Description Inhibition of PCAF (unknown origin) using histone H3 derived peptide as substrate after 20 mins by fluorescence assay |
Bioorg Med Chem Lett 24: 113-6 (2013)
Article DOI: 10.1016/j.bmcl.2013.11.060 BindingDB Entry DOI: 10.7270/Q2WD4222 |
More data for this Ligand-Target Pair | |
Histone acetyltransferase KAT2B
(Homo sapiens (Human)) | BDBM50445038
(CHEMBL3098705)Show SMILES [#6]-[#6@@H](-[#8])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6])-[#7]-[#6](-[#6])=O)-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-n1cc(-[#6]-[#16]-[#6]-[#6]-[#7]-[#6](=O)-[#6]-[#6]-[#7]-[#6](=O)-[#6@@H](-[#8])C([#6])([#6])[#6]-[#8]P([#8])(=O)[#8]P([#8])(=O)[#8]-[#6]-[#6@H]-2-[#8]-[#6@H](-[#6@H](-[#8])-[#6@@H]-2-[#8]P([#8])([#8])=O)-n2cnc3c(-[#7])ncnc23)nn1)-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@H]-1-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](-[#7])=O |r| Show InChI InChI=1S/C78H136N31O31P3S/c1-41(96-44(4)112)65(119)100-49(19-13-25-89-76(83)84)68(122)101-48(17-8-11-24-80)69(123)103-51(35-110)70(124)104-57(43(3)111)72(126)92-32-55(114)91-33-56(115)98-47(66(120)97-42(2)74(128)108-30-15-21-52(108)71(125)102-50(20-14-26-90-77(85)86)67(121)99-46(63(82)118)16-7-10-23-79)18-9-12-29-107-34-45(105-106-107)37-144-31-28-87-54(113)22-27-88-73(127)61(117)78(5,6)38-137-143(134,135)140-142(132,133)136-36-53-60(139-141(129,130)131)59(116)75(138-53)109-40-95-58-62(81)93-39-94-64(58)109/h34,39-43,46-53,57,59-61,75,110-111,116-117H,7-33,35-38,79-80H2,1-6H3,(H2,82,118)(H,87,113)(H,88,127)(H,91,114)(H,92,126)(H,96,112)(H,97,120)(H,98,115)(H,99,121)(H,100,119)(H,101,122)(H,102,125)(H,103,123)(H,104,124)(H,132,133)(H,134,135)(H2,81,93,94)(H4,83,84,89)(H4,85,86,90)(H2,129,130,131)/t41-,42-,43+,46-,47-,48-,49-,50-,51-,52-,53+,57-,59+,60+,61+,75+/m0/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.17E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Utrecht University
Curated by ChEMBL
| Assay Description Competitive inhibition of PCAF (unknown origin) using histone H3 derived peptide as substrate after 20 mins by fluorescence assay |
Bioorg Med Chem Lett 24: 113-6 (2013)
Article DOI: 10.1016/j.bmcl.2013.11.060 BindingDB Entry DOI: 10.7270/Q2WD4222 |
More data for this Ligand-Target Pair | |