Search and Browse
Download
Enter Data
BDBM10352 1-(4-Methylthiobenzyl)-5-(2-(pyridin-3-yl-oxymethyl)-pyrrolidine-1-sulfonyl)-1H-indole-2,3-dione::1-{[4-(methylsulfanyl)phenyl]methyl}-5-{[(2S)-2-[(pyridin-3-yloxy)methyl]pyrrolidine-1-]sulfonyl}-2,3-dihydro-1H-indole-2,3-dione::Pyridine Analogue 21d
SMILES: CSc1ccc(CN2C(=O)C(=O)c3cc(ccc23)S(=O)(=O)N2CCC[C@H]2COc2cccnc2)cc1
InChI Key: InChIKey=IZQMNYSMAWSYDA-UHFFFAOYSA-N
Data: 6 IC50
| Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Caspase-3 (Human) | BDBM10352![]() (1-{[4-(methylsulfanyl)phenyl]methyl}-5-{[(2S)-2-[(...) | GoogleScholar | UniChem | n/a | n/a | 4.40 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Caspase-7 (Human) | BDBM10352![]() (1-{[4-(methylsulfanyl)phenyl]methyl}-5-{[(2S)-2-[(...) | GoogleScholar | UniChem | n/a | n/a | 23.3 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Caspase-1 (Human) | BDBM10352![]() (1-{[4-(methylsulfanyl)phenyl]methyl}-5-{[(2S)-2-[(...) | GoogleScholar | UniChem | n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Caspase-6 (Human) | BDBM10352![]() (1-{[4-(methylsulfanyl)phenyl]methyl}-5-{[(2S)-2-[(...) | GoogleScholar | UniChem | n/a | n/a | >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Caspase-8 (Human) | BDBM10352![]() (1-{[4-(methylsulfanyl)phenyl]methyl}-5-{[(2S)-2-[(...) | GoogleScholar | UniChem | n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Caspase-3 (Human) | BDBM10352![]() (1-{[4-(methylsulfanyl)phenyl]methyl}-5-{[(2S)-2-[(...) | GoogleScholar | UniChem | n/a | n/a | 4.37 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||