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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03219457

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
MNL4,N-DIMETHYLNORLEUCINEC1CWC0.75
SHRN-(5-AMINO-5-CARBOXYPENTYL)GLUTAMIC ACIDA,B,C,D,E,F,
G,H
1E5Q0.75
DPRD-PROLINEP1MCB0.71
DPRD-PROLINEA,B,C,H,K,L2R5B0.71
DPRD-PROLINEA2KDQ0.71
DPRD-PROLINEP1MCS0.71
DPRD-PROLINEA,B2AXI0.71
DPRD-PROLINEA1JY90.71
DPRD-PROLINEA2JUE0.71
DPRD-PROLINEP1MCK0.71
DPRD-PROLINEP1MCR0.71
DPRD-PROLINEA2D550.71
DPRD-PROLINEA1T8J0.71
DPRD-PROLINEA,B2EJ60.71
DPRD-PROLINEP1MCE0.71
DPRD-PROLINEP1MCI0.71
DPRD-PROLINEA,B1SNE0.71
DPRD-PROLINEA,B,C1QFI0.71
DPRD-PROLINEA,P1MCD0.71
DPRD-PROLINEA1ICL0.71
DPRD-PROLINEP1MCQ0.71
DPRD-PROLINEG,M,P,S2I5Y0.71
DPRD-PROLINEA,B,C,D3BOG0.71
DPRD-PROLINEA,L1ZEA0.71
DPRD-PROLINEA,B173D0.71
DPRD-PROLINEA,P1MCJ0.71
DPRD-PROLINEA,B,C1A7Y0.71
DPRD-PROLINEA1IC90.71
DPRD-PROLINEA,B1JY60.71
DPRD-PROLINEA209D0.71
DPRD-PROLINEA1BFW0.71
DPRD-PROLINEA,B1O6I0.71
DPRD-PROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V,W,X
1UNJ0.71
DPRD-PROLINEA,B,C,D2R3C0.71
DPRD-PROLINEA,B,C,D1I3W0.71
DPRD-PROLINEA316D0.71
DPRD-PROLINEA,B,C,D1SN90.71
DPRD-PROLINEA,B,C,H,K,L2R5D0.71
DPRD-PROLINEA,B2Q330.71
DPRD-PROLINEG,M,P,S2I600.71
DPRD-PROLINEA,B1JY40.71
DPRD-PROLINEP1MCF0.71
DPRD-PROLINEA,B,C,D,E,F1UNM0.71
DPRD-PROLINEA1ICO0.71
DPRD-PROLINEA,B1XOF0.71
DPRD-PROLINEP1MCC0.71
DPRD-PROLINEA,B,C,D1SNA0.71
ABX5-[1-(ACETYLAMINO)-3-METHYLBUTYL]-
4-(METHOXYCARBONYL)PROLINE
A1XOE0.74
KAI3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINEA1P1N0.86
KAI3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINEA1LBB0.86
KAI3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINEA,B3C340.86
KAI3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINEA1XHY0.86
KAI3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINEA2ANJ0.86
KAI3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINEA,B3C320.86
KAI3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINEA1FTK0.86
KAI3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINEA1GR20.86
KAI3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINEA,B1TT10.86
KAI3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINEA1FW00.86
KAI3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINEA,B3C350.86
KAI3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINEA,B3C360.86
KAI3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINEA,B3C330.86
KAI3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINEA,B3C310.86
KAI3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINEA3EN30.86
MCP2-CARBOXY-4-METHYLPIPERIDINEH1ETR0.73
OICOCTAHYDROINDOLE-2-CARBOXYLIC ACIDB,C3BV90.72
OICOCTAHYDROINDOLE-2-CARBOXYLIC ACIDA1BDK0.72
X7O5-AMINO-3-METHYL-PYRROLIDINE-2-
CARBOXYLIC ACID
A1L2Q0.73
52A(2R,4R)-4-aminopyrrolidine-2,4-
dicarboxylic acid
A,B2E4Y0.78
DPL4-OXOPROLINEA,B,C1QFI0.71
BG45-(HYDROXY-METHYL-AMINO)-3-METHYL-
PYRROLIDINE-2-CARBOXYLIC ACID
A1TV30.71
BG55-HYDROXYAMINO-3-METHYL-PYRROLIDINE-
2-CARBOXYLIC ACID
A1TV20.71
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B1O5K0.7
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B3CPR0.7
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B2VC60.7
DOQ(2S,3S,4S)-2-CARBOXY-4-[(1Z,3E,5R)-
5-CARBOXY-1-METHYL-1,3-HEXADIENYL]-
3-PYRROLIDINEACETIC ACID
A,B,C,D,E,F1YAE0.77
DOQ(2S,3S,4S)-2-CARBOXY-4-[(1Z,3E,5R)-
5-CARBOXY-1-METHYL-1,3-HEXADIENYL]-
3-PYRROLIDINEACETIC ACID
A,B2PBW0.77
POMCIS-5-METHYL-4-OXOPROLINEA,B1A7Z0.76
SSC(2S,5S)-5-CARBOXYMETHYLPROLINEA,B,C,D1Q190.72