Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Echinococcus multilocularis | bifunctional protein NCOAT | 1.1022 | 1 | 0.5 |
Loa Loa (eye worm) | hyaluronidase | 1.1022 | 1 | 1 |
Schistosoma mansoni | Hyaluronidase | 1.1022 | 1 | 0.5 |
Echinococcus granulosus | bifunctional protein NCOAT | 1.1022 | 1 | 0.5 |
Schistosoma mansoni | aminopeptidase P homologue (M24 family) | 1.1022 | 1 | 0.5 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
Activity (functional) | 0 | Compound was evaluated for the inhibition of replication of HIV-1 in MT-4 (human T helper) cells up to 300 uM; Not active | ChEMBL. | No reference |
CC50 (ADMET) | = 486 uM | Compound concentration that cause 50% cytotoxicity was determined by neutral red uptake in 2.2.15 Cells | ChEMBL. | No reference |
CC50 (ADMET) | = 517 uM | Compound concentration that cause 50% cytotoxicity was determined by neutral red uptake in 2.2.15 Cells | ChEMBL. | No reference |
EC50 (functional) | 0 uM | Compound concentration required to inhibit 50% of intracellular replicating HBV (Hepatitis B virus) RI in human hepatoma cell line 2.2.15; ND : Not determined | ChEMBL. | No reference |
EC50 (functional) | = 2.3 uM | Compound concentration required to inhibit 50% of extracellular replicating HBV (Hepatitis B virus) virion in human hepatoma cell line 2.2.15 | ChEMBL. | No reference |
EC50 (functional) | = 12.5 uM | Compound concentration required to inhibit 50% of extracellular replicating HBV (Hepatitis B virus) virion in human hepatoma cell line 2.2.15 | ChEMBL. | No reference |
EC90 (functional) | 0 uM | Compound concentration required to inhibit 90% of intracellular replicating HBV (Hepatitis B virus) RI in human hepatoma cell line 2.2.15; ND : Not determined | ChEMBL. | No reference |
EC90 (functional) | = 10.9 uM | Compound concentration required to inhibit 90% of extracellular replicating HBV (Hepatitis B virus) virion in human hepatoma cell line 2.2.15 | ChEMBL. | No reference |
EC90 (functional) | = 107.6 uM | Compound concentration required to inhibit 90% of extracellular replicating HBV (Hepatitis B virus) virion in human hepatoma cell line 2.2.15 | ChEMBL. | No reference |
SI (functional) | = 5.7 | Selectivity index (SI) is the ratio of CC50/EC90 for HBV virion | ChEMBL. | No reference |
SI (functional) | = 45 | Selectivity index (SI) is the ratio of CC50/EC90 for HBV virion | ChEMBL. | No reference |
Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.