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BDBM50241352 2-[(4R,7S,10S,13S,19S,22S,25S,28S,31S,34R)-34-[(2S,3S)-2-amino-3-methylpentanamido]-7-(3-carbamimidamidopropyl)-4-{[(1S,2R)-1-carbamoyl-2-hydroxypropyl]carbamoyl}-25-(2-carbamoylethyl)-10,13-bis(1H-imidazol-5-ylmethyl)-19-(1H-indol-3-ylmethyl)-6,9,12,15,18,21,24,27,30,33-decaoxo-28,31-bis(propan-2-yl)-1,2-dithia-5,8,11,14,17,20,23,26,29,32-decaazacyclopentatriacontan-22-yl]acetic acid::CHEMBL266963::COMPSTATIN::ICVVQDWGHHRCT-NH2
SMILES: CC[C@H](C)[C@H](N)C(=O)N[C@H]1CSSC[C@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)CNC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)C(C)C)C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(N)=O
InChI Key: InChIKey=RDTRHBCZFDCUPW-UHFFFAOYSA-N
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Complement C3 (Human) | BDBM50241352![]() (CHEMBL266963 | ICVVQDWGHHRCT-NH2 | 2-[(4R,7S,10S,1...) | GoogleScholar | UniChem | n/a | n/a | 1.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Complement C3 (Human) | BDBM50241352![]() (CHEMBL266963 | ICVVQDWGHHRCT-NH2 | 2-[(4R,7S,10S,1...) | GoogleScholar | UniChem | n/a | n/a | 6.30E+4 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Complement C3 (Human) | BDBM50241352![]() (CHEMBL266963 | ICVVQDWGHHRCT-NH2 | 2-[(4R,7S,10S,1...) | GoogleScholar | UniChem | n/a | n/a | n/a | 1.30E+3 | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Complement factor B (Human) | BDBM50241352![]() (CHEMBL266963 | ICVVQDWGHHRCT-NH2 | 2-[(4R,7S,10S,1...) | GoogleScholar | UniChem | n/a | n/a | 1.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Complement factor B (Human) | BDBM50241352![]() (CHEMBL266963 | ICVVQDWGHHRCT-NH2 | 2-[(4R,7S,10S,1...) | GoogleScholar | UniChem | n/a | n/a | 3.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||