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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02893953

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
NPOP-NITROPHENOLA,B1Z440.89
NPOP-NITROPHENOLX2ZYW0.89
NPOP-NITROPHENOLH,L1YEK0.89
NPOP-NITROPHENOLA,C,E,G43CA0.89
NPOP-NITROPHENOLA1LS60.89
NPOP-NITROPHENOLX2ZVP0.89
NPOP-NITROPHENOLA,B2I100.89
NPOP-NITROPHENOLA1VAH0.89
NPOP-NITROPHENOLA,B3ETT0.89
NPOP-NITROPHENOLA,B2D200.89
NPOP-NITROPHENOLX2ZYV0.89
4NS4-nitrophenyl sulfateX2ZYU0.83
NCHP-NITROPHENYL-PHOSPHOCHOLINEL1DL70.74
NPE5-(PARA-NITROPHENYL PHOSPHONATE)-
PENTANOIC ACID
H1GAF0.76
NPE5-(PARA-NITROPHENYL PHOSPHONATE)-
PENTANOIC ACID
H1AJ70.76
PNA4'-NITROPHENYL-ALPHA-D-MANNOPYRANOSIDEA,B,C,D1VAM0.71
BPNPARANITROBENZYL ALCOHOLH,L1YEG0.7
2AF2-AMINOPHENOLA1L4N0.81
4NP4-NITROPHENYL PHOSPHATEA,B1D1Q0.82
4NP4-NITROPHENYL PHOSPHATEA,B1VE70.82
4NP4-NITROPHENYL PHOSPHATEA2I6P0.82
ANX2,5-DINITROPHENOLA,B,C,D,E,F,
G,H
2BFG0.87
DNC3,5-DINITROCATECHOLA3BWY0.83
DNC3,5-DINITROCATECHOLA3BWM0.83
DNC3,5-DINITROCATECHOLA1VID0.83
NIYMETA-NITRO-TYROSINEA2ADP0.72
NIYMETA-NITRO-TYROSINEA3DIV0.72
NIYMETA-NITRO-TYROSINEA2H5U0.72
NIYMETA-NITRO-TYROSINEA1K4Q0.72
NIYMETA-NITRO-TYROSINEB,G,O,Y1SDA0.72
KHP2-HYDROXYMETHYL-5-(4-NITRO-PHENOXY)-
TETRAHYDRO-FURAN-3,4-DIOL
A,B1QW90.71
M2F2,4-DINITROPHENYL 2-DEOXY-2-FLUORO-
BETA-D-MANNOPYRANOSIDE
A,B2WBK0.7
NPA2-(4-HYDROXY-3-NITROPHENYL)ACETIC ACIDH1NGP0.74
PNPMETHYL-PHOSPHONIC ACID MONO-(4-
NITRO-PHENYL) ESTER
A,B,D,F1KNO0.8
PNPMETHYL-PHOSPHONIC ACID MONO-(4-
NITRO-PHENYL) ESTER
A1ZED0.8
1471-O-[P-NITROPHENYL]-BETA-D-GALACTOPYRANOSEA,B,C1KRV0.71
1471-O-[P-NITROPHENYL]-BETA-D-GALACTOPYRANOSEA,B,C,D1JYW0.71
PNG4'-NITROPHENYL-ALPHA-D-GLUCOPYRANOSIDEA2ZOX0.71
PNG4'-NITROPHENYL-ALPHA-D-GLUCOPYRANOSIDEA,B,C,D1VAL0.71
1451-O-[O-NITROPHENYL]-BETA-D-GALACTOPYRANOSEA,B,C2PE50.72
1451-O-[O-NITROPHENYL]-BETA-D-GALACTOPYRANOSEA,B,C,D1JYV0.72
2AC2-AMINO-P-CRESOLH,I1A2C0.73
2AC2-AMINO-P-CRESOLA1L4M0.73
CSNN,4-DIHYDROXY-N-OXO-3-(SULFOOXY)BENZENAMINIUMP1E2S0.8
CSNN,4-DIHYDROXY-N-OXO-3-(SULFOOXY)BENZENAMINIUMA1PA90.8
DNT2-[1-METHYLHEXYL]-4,6-DINITROPHENOLA,B,C1NEN0.77
B4Nbis(4-nitrophenyl) hydrogen phosphateA3DH80.77
NFG2,4-DINITROPHENYL 2-DEOXY-2-FLUORO-
BETA-D-GLUCOPYRANOSIDE
A2PB10.7
NFG2,4-DINITROPHENYL 2-DEOXY-2-FLUORO-
BETA-D-GLUCOPYRANOSIDE
A1E4I0.7
NFG2,4-DINITROPHENYL 2-DEOXY-2-FLUORO-
BETA-D-GLUCOPYRANOSIDE
A1UYQ0.7
DNF2,4-DINITROPHENOLA,B2B160.91
DNF2,4-DINITROPHENOLH,J,L,N1OAU0.91
DNF2,4-DINITROPHENOLA1GVO0.91
DNF2,4-DINITROPHENOLA,B2B150.91
DNF2,4-DINITROPHENOLA,B2B140.91
NCR2-NITRO-P-CRESOLA,B1AHV0.84
4NL4-AMINOPHENOLA2ORL0.79
EPN3-(4-NITRO-PHENOXY)-PROPAN-1-OLA2SAM0.78
NPFORTHONITROPHENYL-BETA-D-FUCOPYRANOSIDEA,B,C1EFA0.72
NPFORTHONITROPHENYL-BETA-D-FUCOPYRANOSIDEA,B2PAF0.72
NPFORTHONITROPHENYL-BETA-D-FUCOPYRANOSIDEA,B,C1JWL0.72
TNFPICRIC ACIDA1GVS0.89
TNFPICRIC ACIDX1VYP0.89
TNFPICRIC ACIDA1VYR0.89
TNFPICRIC ACIDX1VYS0.89
4NC4-NITROCATECHOLA1NO30.83
4NC4-NITROCATECHOLB2BUU0.83
4NC4-NITROCATECHOLB2BUZ0.83
4NC4-NITROCATECHOLB1EOC0.83
BRS2-[1-(4-CHLORO-PHENYL)-ETHYL]-4,6-
DINITRO-PHENOL
A,B,D,M,N,O,P1KFY0.72