Indimicin D
| Internal ID | 715c2625-fa89-4233-b546-a3b8f336f5f9 |
| Taxonomy | Organoheterocyclic compounds > Indoles and derivatives > Carbazoles > Pyrrolocarbazoles > Indolocarbazoles |
| IUPAC Name | (2S,10R)-7,19-dichloro-3,10-dimethyl-3,13,23-triazahexacyclo[14.7.0.02,10.04,9.011,15.017,22]tricosa-1(16),4(9),5,7,11,14,17(22),18,20-nonaene |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C22H17Cl2N3/c1-22-15-8-12(24)4-6-18(15)27(2)21(22)20-19(14-9-25-10-16(14)22)13-7-11(23)3-5-17(13)26-20/h3-10,21,25-26H,1-2H3/t21-,22+/m1/s1 |
| InChI Key | LDQFIYNIQYYGSV-YADHBBJMSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C22H17Cl2N3 |
| Molecular Weight | 394.30 g/mol |
| Exact Mass | 393.0799529 g/mol |
| Topological Polar Surface Area (TPSA) | 34.80 Ų |
| XlogP | 5.50 |
| (2S,10R)-7,19-dichloro-3,10-dimethyl-3,13,23-triazahexacyclo[14.7.0.02,10.04,9.011,15.017,22]tricosa-1(16),4(9),5,7,11,14,17(22),18,20-nonaene |
| (2S,10R)-7,19-dichloro-3,10-dimethyl-3,13,23-triazahexacyclo(14.7.0.02,10.04,9.011,15.017,22)tricosa-1(16),4(9),5,7,11,14,17(22),18,20-nonaene |
| RefChem:148141 |
| CHEMBL3326890 |
| CHEBI:200152 |
| Target | Value | Probability (raw) | Probability (%) |
|---|---|---|---|
| No predicted properties yet! | |||
Proven Targets:
| CHEMBL ID | UniProt ID | Name | Min activity | Assay type | Source |
|---|---|---|---|---|---|
| No proven targets yet! | |||||
Predicted Targets (via Super-PRED):
| CHEMBL ID | UniProt ID | Name | Probability | Model accuracy |
|---|---|---|---|---|
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 98.43% | 94.45% |
| CHEMBL4016 | P42262 | Glutamate receptor ionotropic, AMPA 2 | 96.10% | 86.92% |
| CHEMBL240 | Q12809 | HERG | 94.90% | 89.76% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 94.12% | 96.09% |
| CHEMBL1163125 | O60885 | Bromodomain-containing protein 4 | 92.91% | 97.31% |
| CHEMBL3155 | P34969 | Serotonin 7 (5-HT7) receptor | 92.17% | 90.71% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 91.39% | 91.11% |
| CHEMBL2000 | P03952 | Plasma kallikrein | 88.75% | 93.92% |
| CHEMBL255 | P29275 | Adenosine A2b receptor | 88.44% | 98.59% |
| CHEMBL2094127 | P06493 | Cyclin-dependent kinase 1/cyclin B | 88.19% | 96.00% |
| CHEMBL222 | P23975 | Norepinephrine transporter | 87.48% | 96.06% |
| CHEMBL4208 | P20618 | Proteasome component C5 | 87.22% | 90.00% |
| CHEMBL2535 | P11166 | Glucose transporter | 86.42% | 98.75% |
| CHEMBL2335 | P42785 | Lysosomal Pro-X carboxypeptidase | 85.97% | 100.00% |
| CHEMBL4026 | P40763 | Signal transducer and activator of transcription 3 | 85.58% | 82.69% |
| CHEMBL2581 | P07339 | Cathepsin D | 84.32% | 98.95% |
| CHEMBL3430907 | Q96GD4 | Aurora kinase B/Inner centromere protein | 84.14% | 97.50% |
| CHEMBL225 | P28335 | Serotonin 2c (5-HT2c) receptor | 83.10% | 89.62% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 83.04% | 95.56% |
| CHEMBL2820 | P03951 | Coagulation factor XI | 82.94% | 95.29% |
| CHEMBL3492 | P49721 | Proteasome Macropain subunit | 82.77% | 90.24% |
| CHEMBL1914 | P06276 | Butyrylcholinesterase | 82.31% | 95.00% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 82.07% | 95.89% |
| CHEMBL5314 | Q06418 | Tyrosine-protein kinase receptor TYRO3 | 82.04% | 96.00% |
| CHEMBL217 | P14416 | Dopamine D2 receptor | 81.13% | 95.62% |
| CHEMBL1907600 | Q00535 | Cyclin-dependent kinase 5/CDK5 activator 1 | 81.00% | 93.03% |
| CHEMBL332 | P03956 | Matrix metalloproteinase-1 | 80.52% | 94.50% |
| CHEMBL2708 | Q16584 | Mitogen-activated protein kinase kinase kinase 11 | 80.32% | 81.14% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 80.12% | 94.00% |
Below are displayed all the plants proven (via scientific papers) to contain this
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| PubChem | 86342741 |
| LOTUS | LTS0213909 |
| wikiData | Q75069460 |