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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03034362

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
BPNPARANITROBENZYL ALCOHOLH,L1YEG0.72
4NC4-NITROCATECHOLA1NO30.86
4NC4-NITROCATECHOLB2BUU0.86
4NC4-NITROCATECHOLB2BUZ0.86
4NC4-NITROCATECHOLB1EOC0.86
NIM4-NITRO-2-PHENOXYMETHANESULFONANILIDEA1ZWP0.73
NIM4-NITRO-2-PHENOXYMETHANESULFONANILIDEA3E9X0.73
NIM4-NITRO-2-PHENOXYMETHANESULFONANILIDEA2OTH0.73
4NL4-AMINOPHENOLA2ORL0.75
NCR2-NITRO-P-CRESOLA,B1AHV0.82
2AC2-AMINO-P-CRESOLH,I1A2C0.71
2AC2-AMINO-P-CRESOLA1L4M0.71
NPA2-(4-HYDROXY-3-NITROPHENYL)ACETIC ACIDH1NGP0.75
NIYMETA-NITRO-TYROSINEA2ADP0.7
NIYMETA-NITRO-TYROSINEA3DIV0.7
NIYMETA-NITRO-TYROSINEA2H5U0.7
NIYMETA-NITRO-TYROSINEA1K4Q0.7
NIYMETA-NITRO-TYROSINEB,G,O,Y1SDA0.7
EDREDROPHONIUM IONA1AX90.72
EDREDROPHONIUM IONA2ACK0.72
DNC3,5-DINITROCATECHOLA3BWY0.85
DNC3,5-DINITROCATECHOLA3BWM0.85
DNC3,5-DINITROCATECHOLA1VID0.85
EPN3-(4-NITRO-PHENOXY)-PROPAN-1-OLA2SAM0.73
4NS4-nitrophenyl sulfateX2ZYU0.84
2AF2-AMINOPHENOLA1L4N0.78
4NP4-NITROPHENYL PHOSPHATEA,B1D1Q0.78
4NP4-NITROPHENYL PHOSPHATEA,B1VE70.78
4NP4-NITROPHENYL PHOSPHATEA2I6P0.78
DNT2-[1-METHYLHEXYL]-4,6-DINITROPHENOLA,B,C1NEN0.73
ANX2,5-DINITROPHENOLA,B,C,D,E,F,
G,H
2BFG0.93
GAAMETANITROPHENYL-ALPHA-D-GALACTOSIDED,E,F,G,H1EEI0.7
GAAMETANITROPHENYL-ALPHA-D-GALACTOSIDED,E,F,G,H,L,
M,N,O,P
1LT60.7
CSNN,4-DIHYDROXY-N-OXO-3-(SULFOOXY)BENZENAMINIUMP1E2S0.88
CSNN,4-DIHYDROXY-N-OXO-3-(SULFOOXY)BENZENAMINIUMA1PA90.88
NCHP-NITROPHENYL-PHOSPHOCHOLINEL1DL70.71
DNF2,4-DINITROPHENOLA,B2B160.86
DNF2,4-DINITROPHENOLH,J,L,N1OAU0.86
DNF2,4-DINITROPHENOLA1GVO0.86
DNF2,4-DINITROPHENOLA,B2B150.86
DNF2,4-DINITROPHENOLA,B2B140.86