Menin/Histone-lysine N-methyltransferase MLL
Target ID: CHEMBL2093861
Organism: Homo sapiens
Type: PROTEIN-PROTEIN INTERACTION
Molecules
| Name | SMILES | Bioactivity | Structure |
|---|---|---|---|
| INAMRINONE | Nc1cc(-c2ccncc2)c[nH]c1=O | Mean ED50: 0.389 mg kg-1 |  |
| SUNITINIB | CCN(CC)CCNC(=O)c1c(C)[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c1C | IC50: 80.0 nM |  |
| QUERCETIN | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 | IC50: 32870.0 nM |  |
| GABEXATE | CCOC(=O)c1ccc(OC(=O)CCCCCNC(=N)N)cc1 | Ki: 27000.0 nM |  |
| DIPYRIDAMOLE | OCCN(CCO)c1nc(N2CCCCC2)c2nc(N(CCO)CCO)nc(N3CCCCC3)c2n1 | IC50: 500.0 nM |  |
Top Fragments
| SMILES | Avg pKi | Count | Structure |
|---|---|---|---|
| [5*]N([5*])[5*] | 6.7 | 78 |  |
| [4*]CC | 6.09 | 65 |  |
| [1*]C([6*])=O | 6.09 | 65 |  |
| [7*]C1C(=O)Nc2ccc(F)cc21 | 7.1 | 39 |  |
| [5*]N[5*] | 7.1 | 39 |  |