BDBM50160860 CHEMBL2373427::Fullerene Derivative

SMILES: [I-].[I-].[H][C@@]12C3=c4c5c6c7c8C(=C9c%10c%11c%12-c%13c%14c%15c%16c%17c%18c(c4c4c5c5c7c7c%19c8[C@]8%20C[N+](C)(C)C[C@]98[C@@]%11([H])[C@]8([H])c%13c9c%11c8c%20c%19c8c%11c%11c(c%159)c%16c9c%18c4c4c9c%11c8c7c54)[C@@]45C[N+](C)(C)C[C@@]34c(c1%10)c%12[C@]%14([H])[C@@]%175[H])[C@@]26[H]

InChI Key: InChIKey=GIMJQUGFAHIIBH-MMKAYAEOSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50160860   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Human immunodeficiency virus type 1 reverse transcriptase (Human immunodeficiency virus 1)	BDBM50160860 (CHEMBL2373427 | Fullerene Derivative) Show SMILES [I-].[I-].[H][C@@]12C3=c4c5c6c7c8C(=C9c%10c%11c%12-c%13c%14c%15c%16c%17c%18c(c4c4c5c5c7c7c%19c8[C@]8%20C[N+](C)(C)C[C@]98[C@@]%11([H])[C@]8([H])c%13c9c%11c8c%20c%19c8c%11c%11c(c%159)c%16c9c%18c4c4c9c%11c8c7c54)[C@@]45C[N+](C)(C)C[C@@]34c(c1%10)c%12[C@]%14([H])[C@@]%175[H])[C@@]26[H] |c:2,t:8| Show InChI InChI=1S/C68H26N2/c1-69(2)5-65-57-41-29-17-9-10-14-11-15-23-31(19(11)17)43(41)59(65)49-37(23)28-36-26(15)34-22(14)30-18(10)20-12-13(9)21(29)33-25-16(12)24-32(20)44-42(30)58-46(34)48(36)62-54-39(28)51(49)63-55-53-40-27(35(25)47(45(33)57)61(53)67(63,65)7-69)38(24)50-52(40)64(56(54)55)68(62)8-70(3,4)6-66(58,68)60(44)50/h39,47,50,54,60-61H,5-8H2,1-4H3/q+2/t39-,47+,50?,54-,60+,61-,65+,66?,67-,68-/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoritsu University of Pharmacy Curated by ChEMBL					Assay Description Inhibitory concentration against HIV-Reverse transcriptase				Bioorg Med Chem Lett 15: 1107-9 (2005) Article DOI: 10.1016/j.bmcl.2004.12.030 BindingDB Entry DOI: 10.7270/Q29C6WZS
					More data for this Ligand-Target Pair
Hepatitis C virus NS5B RNA-dependent RNA polymerase (Hepatitis C virus)	BDBM50160860 (CHEMBL2373427 | Fullerene Derivative) Show SMILES [I-].[I-].[H][C@@]12C3=c4c5c6c7c8C(=C9c%10c%11c%12-c%13c%14c%15c%16c%17c%18c(c4c4c5c5c7c7c%19c8[C@]8%20C[N+](C)(C)C[C@]98[C@@]%11([H])[C@]8([H])c%13c9c%11c8c%20c%19c8c%11c%11c(c%159)c%16c9c%18c4c4c9c%11c8c7c54)[C@@]45C[N+](C)(C)C[C@@]34c(c1%10)c%12[C@]%14([H])[C@@]%175[H])[C@@]26[H] |c:2,t:8| Show InChI InChI=1S/C68H26N2/c1-69(2)5-65-57-41-29-17-9-10-14-11-15-23-31(19(11)17)43(41)59(65)49-37(23)28-36-26(15)34-22(14)30-18(10)20-12-13(9)21(29)33-25-16(12)24-32(20)44-42(30)58-46(34)48(36)62-54-39(28)51(49)63-55-53-40-27(35(25)47(45(33)57)61(53)67(63,65)7-69)38(24)50-52(40)64(56(54)55)68(62)8-70(3,4)6-66(58,68)60(44)50/h39,47,50,54,60-61H,5-8H2,1-4H3/q+2/t39-,47+,50?,54-,60+,61-,65+,66?,67-,68-/m0/s1	UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	310	n/a	n/a	n/a	n/a	n/a	n/a
Kyoritsu University of Pharmacy Curated by ChEMBL					Assay Description Inhibitory concentration against Hepatitis C virus-RNA-dependent RNA polymerase				Bioorg Med Chem Lett 15: 1107-9 (2005) Article DOI: 10.1016/j.bmcl.2004.12.030 BindingDB Entry DOI: 10.7270/Q29C6WZS
					More data for this Ligand-Target Pair