Molecule Details
| InChIKey | HKSZLNNOFSGOKW-ZGQXJOJZSA-N |
|---|---|
| Compound Name | Indolocarbazole nitrogen derivative |
| Canonical SMILES | CN[C@@H]1CC2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 |
| Clinical Status | Clinical Multi-Target |
| Targets (Human+Pathogen) | 49 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 7.92 |
| Source | BindingDB;ChEMBL;TTD_MultiTarget |
2D Structure
Activity Profile
Target Activities (49)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P08922 | ROS1 | Homo sapiens | Human | PF00041 PF07714 | 10.2 | IC50 | BindingDB |
| P24941 | CDK2 | Homo sapiens | Human | PF00069 | 9.4 | pIC50 | TTD_MultiTarget |
| P31749 | AKT1 | Homo sapiens | Human | PF00169 PF00069 PF00433 | 9.4 | pIC50 | TTD_MultiTarget |
| P06493 | CDK1 | Homo sapiens | Human | PF00069 | 9.4 | pIC50 | TTD_MultiTarget |
| P11802 | CDK4 | Homo sapiens | Human | PF00069 | 9.2 | pIC50 | TTD_MultiTarget |
| P36888 | FLT3 | Homo sapiens | Human | PF00047 PF07714 | 9.1 | IC50 | BindingDB |
| Q02161 | RHD | Homo sapiens | Human | PF00909 | 9.1 | pIC50 | TTD_MultiTarget |
| Q5S007 | LRRK2 | Homo sapiens | Human | PF23745 PF23744 PF23748 PF16095 PF25497 PF13855 PF00069 PF08477 | 9.0 | IC50 | BindingDB |
| Q02156 | PRKCE | Homo sapiens | Human | PF00130 PF00168 PF00069 PF00433 | 8.9 | IC50 | BindingDB |
| P07948 | LYN | Homo sapiens | Human | PF07714 PF00017 PF00018 | 8.9 | IC50 | BindingDB |
| P28482 | MAPK1 | Homo sapiens | Human | PF00069 | 8.6 | IC50 | BindingDB |
| P24385 | CCND1 | Homo sapiens | Human | PF02984 PF00134 | 8.5 | IC50 | BindingDB |
| P43405 | SYK | Homo sapiens | Human | PF07714 PF00017 | 8.5 | IC50 | BindingDB |
| P05771 | PRKCB | Homo sapiens | Human | PF00130 PF00168 PF00069 PF00433 | 8.4 | IC50 | BindingDB |
| P24864 | CCNE1 | Homo sapiens | Human | PF02984 PF00134 | 8.4 | IC50 | BindingDB |
| P06239 | LCK | Homo sapiens | Human | PF07714 PF00017 PF00018 | 8.3 | IC50 | BindingDB |
| P35968 | KDR | Homo sapiens | Human | PF07679 PF00047 PF13895 PF22971 PF07714 PF21339 PF17988 PF22854 | 8.3 | IC50 | ChEMBL;BindingDB |
| P52333 | JAK3 | Homo sapiens | Human | PF18379 PF18377 PF17887 PF07714 PF21990 | 8.2 | IC50 | BindingDB |
| Q9UKE5 | TNIK | Homo sapiens | Human | PF00780 PF00069 | 8.1 | IC50 | BindingDB |
| Q15046 | KARS1 | Homo sapiens | Human | PF00152 PF01336 | 8.1 | IC50 | BindingDB |
| P11309 | PIM1 | Homo sapiens | Human | PF00069 | 8.0 | IC50 | BindingDB |
| Q15078 | CDK5R1 | Homo sapiens | Human | PF03261 | 8.0 | IC50 | BindingDB |
| P50750 | CDK9 | Homo sapiens | Human | PF00069 | 7.9 | IC50 | BindingDB |
| O14965 | AURKA | Homo sapiens | Human | PF00069 | 7.7 | IC50 | BindingDB |
| P05129 | PRKCG | Homo sapiens | Human | PF00130 PF00168 PF00069 PF00433 | 7.7 | IC50 | BindingDB |
| P10721 | KIT | Homo sapiens | Human | PF00047 PF07714 | 7.7 | Kd | BindingDB |
| P11362 | FGFR1 | Homo sapiens | Human | PF07679 PF00047 PF07714 | 7.7 | pIC50 | TTD_MultiTarget |
| Q02763 | TEK | Homo sapiens | Human | PF00041 PF10430 PF07714 | 7.7 | pIC50 | TTD_MultiTarget |
| Q16584 | MAP3K11 | Homo sapiens | Human | PF07714 PF14604 | 7.7 | Kd | BindingDB |
| O96017 | CHEK2 | Homo sapiens | Human | PF00498 PF00069 | 7.6 | IC50 | BindingDB |
| Q9P1W9 | PIM2 | Homo sapiens | Human | PF00069 | 7.5 | IC50 | BindingDB |
| P18505 | GABRB1 | Homo sapiens | Human | PF02931 PF02932 | 7.5 | pIC50 | TTD_MultiTarget |
| P06729 | CD2 | Homo sapiens | Human | PF05790 PF07686 | 7.5 | pIC50 | TTD_MultiTarget |
| P08069 | IGF1R | Homo sapiens | Human | PF00757 PF07714 PF01030 | 7.5 | IC50 | BindingDB |
| P49841 | GSK3B | Homo sapiens | Human | PF00069 | 7.5 | IC50 | BindingDB |
| P06241 | FYN | Homo sapiens | Human | PF07714 PF00017 PF00018 | 7.4 | IC50 | BindingDB |
| O15111 | CHUK | Homo sapiens | Human | PF18397 PF12179 PF00069 | 7.4 | IC50 | BindingDB |
| Q05655 | PRKCD | Homo sapiens | Human | PF00130 PF21494 PF00069 PF00433 | 7.4 | IC50 | BindingDB |
| Q02750 | MAP2K1 | Homo sapiens | Human | PF00069 | 7.4 | IC50 | BindingDB |
| Q06418 | TYRO3 | Homo sapiens | Human | PF00041 PF07679 PF07714 | 7.3 | IC50 | BindingDB |
| P43403 | ZAP70 | Homo sapiens | Human | PF07714 PF00017 | 7.3 | IC50 | BindingDB |
| P08581 | MET | Homo sapiens | Human | PF07714 PF01437 PF01403 PF01833 | 7.2 | pIC50 | TTD_MultiTarget |
| P00533 | EGFR | Homo sapiens | Human | PF00757 PF14843 PF07714 PF01030 PF21314 | 7.0 | IC50 | BindingDB |
| Q99683 | MAP3K5 | Homo sapiens | Human | PF19039 PF20309 PF20302 PF13281 PF00069 | 7.0 | IC50 | BindingDB |
| P12931 | SRC | Homo sapiens | Human | PF07714 PF00017 PF00018 | 6.5 | IC50 | BindingDB |
| P41743 | PRKCI | Homo sapiens | Human | PF00130 PF00564 PF00069 PF00433 | 6.4 | IC50 | BindingDB |
| P49137 | MAPKAPK2 | Homo sapiens | Human | PF00069 | 6.4 | IC50 | BindingDB |
| O14920 | IKBKB | Homo sapiens | Human | PF18397 PF12179 PF00069 | 6.3 | IC50 | BindingDB |
| P51946 | CCNH | Homo sapiens | Human | PF16899 PF00134 | 6.0 | IC50 | BindingDB |