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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00728171

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
GNBS-P-NITROBENZYLOXYCARBONYLGLUTATHIONEA,B,C,D1QIP0.72
PNCPARA-NITROBENZYL GLUTARYL GLYCINIC ACIDL1YEF0.77
ICXmethyl N-[(5Z)-6-({[4-(4-iodobenzyl)phenyl]carbonyl}amino)hex-
5-enoyl]glycinate
A,C,D,E,G,P,
Q,R,W
3CWB0.71
BANHONH-BENZYLMALONYL-L-ALANYLGLYCINE-
P-NITROANILIDE
A5TLN0.7
NC1NITROCEFIN ACYL-SERINEA,B1MWS0.74
NC1NITROCEFIN ACYL-SERINEA2UWX0.74
TINA,B1N940.71
BEL2,4-DINITRO,5-[BIS(2-BROMOETHYL)AMINO]-
N-(2',3'-DIOXOPROPYL)BENZAMIDE
A,B1OON0.71
B22[2,2'-{[2-({3-[({2-[4-(AMINOSULFONYL)PHENYL]ETHYL}AMINO)CARBONYL]PHENYL}AMINO)-
2-OXOETHYL]IMINO}DIACETATO(2-)-
KAPPAO]COPPER
A2FOU0.7
PPNPARA-NITROPHENYLALANINEI1YTJ0.7
RA4N-(4-NITROBENZOYL)-L-LEUCYL-N-(4-
{[AMINO(IMINO)METHYL]AMINO}BUTYL)-
L-PROLINAMIDE
H,I1YPM0.72
B3N4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE-
N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE
A,B3F060.7
B3N4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE-
N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE
A,B3EZP0.7
B3N4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE-
N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE
A3EW80.7
B3N4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE-
N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE
A,B3EZT0.7
B3N4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE-
N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE
A1T670.7
S2DN-BENZOYL-D-ALANINEA,B2JCI0.72
GDNGLUTATHIONE S-(2,4 DINITROBENZENE)A,B5GST0.72
GDNGLUTATHIONE S-(2,4 DINITROBENZENE)A1HNA0.72
GDNGLUTATHIONE S-(2,4 DINITROBENZENE)A,B1VF30.72
GDNGLUTATHIONE S-(2,4 DINITROBENZENE)A,B,C,D1HNC0.72
GDNGLUTATHIONE S-(2,4 DINITROBENZENE)A,B,C1XWK0.72
GDNGLUTATHIONE S-(2,4 DINITROBENZENE)A,B18GS0.72
GDNGLUTATHIONE S-(2,4 DINITROBENZENE)A1GSQ0.72
GDNGLUTATHIONE S-(2,4 DINITROBENZENE)A,B1HNB0.72
G23(2R,4S)-2-[(R)-BENZYLCARBAMOYL-
PHENYLACETYL-METHYL]-5,5-DIMETHYL-
THIAZOLIDINE-4-CARBOXYLIC ACID
A1HTE0.7
GTBS-(P-NITROBENZYL)GLUTATHIONEA,B2OAD0.78
GTBS-(P-NITROBENZYL)GLUTATHIONEA,B,C,D,E,F1GTI0.78
GTBS-(P-NITROBENZYL)GLUTATHIONEA,B2OAC0.78
GTBS-(P-NITROBENZYL)GLUTATHIONEA,B1GLQ0.78
GTBS-(P-NITROBENZYL)GLUTATHIONEB,D2QMC0.78
GTBS-(P-NITROBENZYL)GLUTATHIONEA,B2VO40.78
GTBS-(P-NITROBENZYL)GLUTATHIONEA,B,C,D1K0C0.78