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Target
Reverse transcriptase/RNaseH
Ligand
BDBM50050639
Substrate
n/a
Meas. Tech.
ChEMBL_195513 (CHEMBL800581)
IC50
3900±n/a nM
Citation
 Gussio, R; Pattabiraman, N; Zaharevitz, DW; Kellogg, GE; Topol, IA; Rice, WG; Schaeffer, CA; Erickson, JW; Burt, SK All-atom models for the non-nucleoside binding site of HIV-1 reverse transcriptase complexed with inhibitors: a 3D QSAR approach. J Med Chem 39:1645-50 (1996) [PubMed]  Article 
Target
Name:
Reverse transcriptase/RNaseH
Synonyms:
HIV-1 Reverse Transcriptase RNase H | Human immunodeficiency virus type 1 reverse transcriptase | Reverse transcriptase/RNaseH
Type:
PROTEIN
Mol. Mass.:
65229.15
Organism:
Human immunodeficiency virus 1
Description:
ChEMBL_1473730
Residue:
566
Sequence:
PISPIETVPVKLKPGMDGPKVKQWPLTEEKIKALVEICTEMEKEGKISKIGPENPYNTPVFAIKKKDSTKWRKLVDFRELNKRTQDFWEVQLGIPHPAGLKKRKSVTVLDVGDAYFSVPLDEDFRKYTAFTIPSINNETPGIRYQYNVLPQGWKGSPAIFQSSMTKILEPFRKQNPDIVIYQYMDDLYVGSDLEIGQHRTKIEELRQHLLRWGLTTPDKKHQKEPPFLWMGYELHPDKWTVQPIVLPEKDSWTVNDIQKLVGKLNWASQIYPGIRVRQLCKLLRGTKALTEVIPLTEEAELELAENREILKEPVHGVYYDPSKDLIAEIQKQGQGQWTYQIYQEPFKNLRTGKYARMRGAHTNDVKQLTEAVQKITTESIVIWGKTPKFKLPIQKETWETWWTEYWQATWIPEWEFVNTPPLVKLWYQLEKEPIVGAETFYVDGAANRETKLGKAGYVTNRGRQKVVTLTDTTNQKTELQAIYLALQDSGLEVNIVTDSQYALGIIQAQPDQSESELVNQIIEQLIKKEKVYLAWVPAHKGIGGNEQVDKLVSAGIRKVLFLDGID
  
Inhibitor
Name:
BDBM50050639
Synonyms:
6-(3,6-Dihydro-2H-pyridin-1-yl)-8-ethyl-8H-1,3a,7,8,9-pentaaza-dibenzo[e,h]azulene | CHEMBL431931
Type:
Small organic molecule
Emp. Form.:
C20H20N6
Mol. Mass.:
344.413
SMILES:
CCN1c2ncccc2-c2nccn2-c2ccc(nc12)N1CCC=CC1 |c:27|
Structure:
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