Name | Azadiradione |
---|---|
PubChem ID | CID_12308714 |
Structure | |
Bioactivity | |
ChEMBL_ID | CHEMBL1215754 |
canonical_SMILES | CC(=O)OC1CC2C(C(=O)C=CC2(C3C1(C4=CC(=O)C(C4(CC3)C)C5=COC=C5)C)C)(C)C |
Isomeric_SMILES | CC(=O)O[C@@H]1C[C@@H]2[C@](C=CC(=O)C2(C)C)([C@@H]3[C@@]1(C4=CC(=O)[C@H]([C@@]4(CC3)C)C5=COC=C5)C)C |
Known_targets | |
SEA_Predictions | O00398,Q9BXC1,Q9UPC5,O60603,Q99677,P43657,Q9H1C0,Q9UBY5,O75417,Q13510,O43772,P29375,P35813,Q5R387,Q9UGP5,Q9NP87,Q4L180,P17252,Q9UBT6,Q5QJU3,Q92633,P63096,P08754,O75592,,Q9HBW0,P23141,Q13822,P39877,P02795,Q7L5A8,P09471,P16109,Q9NYA1,Q02156,P15692,O95136,Q02083,P05413,Q05193,P0C869,Q86W28,P14555,Q6QHF9,P24666,P16885,Q8TCC7,Q9Y4D2,Q9UJM8,P34913,P28838,P37058,Q9H228 |
HitPickv2_Predictions | |
SWISS Predictions |
Name | Azadiradione |
---|---|
PubChem ID | CID_12308714 |
Structure | |
Bioactivity | |
ChEMBL_ID | CHEMBL1215754 |
canonical_SMILES | CC(=O)OC1CC2C(C(=O)C=CC2(C3C1(C4=CC(=O)C(C4(CC3)C)C5=COC=C5)C)C)(C)C |
Isomeric_SMILES | CC(=O)O[C@@H]1C[C@@H]2[C@](C=CC(=O)C2(C)C)([C@@H]3[C@@]1(C4=CC(=O)[C@H]([C@@]4(CC3)C)C5=COC=C5)C)C |
ChEMBL_ID | |
SEA ChEMBL_ID | CHEMBL3562166,CHEMBL3562167,CHEMBL3562165,CHEMBL4163,CHEMBL5968,CHEMBL2331058,CHEMBL5700,CHEMBL3250,CHEMBL6025,CHEMBL5463,CHEMBL2216740,CHEMBL2424504,CHEMBL2437,CHEMBL2097,CHEMBL5367,CHEMBL1914260,CHEMBL299,CHEMBL5365,CHEMBL2331067,CHEMBL3819,CHEMBL4741,CHEMBL4221,CHEMBL3724,CHEMBL2265,CHEMBL3691,CHEMBL4323,CHEMBL4742,CHEMBL5378,CHEMBL4394,CHEMBL3582,CHEMBL1783,CHEMBL2955,CHEMBL4349,CHEMBL3344,CHEMBL4958,CHEMBL4136,CHEMBL3474,CHEMBL2105,CHEMBL4903,CHEMBL4100,CHEMBL1641348,CHEMBL5545,CHEMBL4229,CHEMBL2409,CHEMBL3965,CHEMBL4234,CHEMBL2274 |
HitPickv_chamble_ID | |
SWISS_Target_chamble ID |