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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02028496

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
52A(2R,4R)-4-aminopyrrolidine-2,4-
dicarboxylic acid
A,B2E4Y0.71
DNMN-METHYL-D-NORLEUCINEA,B1S1O0.72
DNMN-METHYL-D-NORLEUCINEA,B1S4A0.72
DNMN-METHYL-D-NORLEUCINEA1R9V0.72
X7O5-AMINO-3-METHYL-PYRROLIDINE-2-
CARBOXYLIC ACID
A1L2Q0.78
CPC2-METHYL-1-METHYLAMINO-CYCLOPROPANE CARBOXYLIC ACIDC,D193D0.75
MCP2-CARBOXY-4-METHYLPIPERIDINEH1ETR0.85
BG45-(HYDROXY-METHYL-AMINO)-3-METHYL-
PYRROLIDINE-2-CARBOXYLIC ACID
A1TV30.73
LY5(3S,4aR,6S,8aR)-6-{[(2S)-2-carboxy-
4,4-difluoropyrrolidin-1-yl]methyl}decahydroisoquinoline-
3-carboxylic acid
A,B,C,D2QS40.7
MLEN-METHYLLEUCINEA,D2J9A0.72
MLEN-METHYLLEUCINEC1IKF0.72
MLEN-METHYLLEUCINEA,M,N2Z6W0.72
MLEN-METHYLLEUCINEB,D,F,H,J,L,
N,P
1C5F0.72
MLEN-METHYLLEUCINED,E,F1XQ70.72
MLEN-METHYLLEUCINEC1CWA0.72
MLEN-METHYLLEUCINEC1CWF0.72
MLEN-METHYLLEUCINEB,D,F,H,J,L,
N,P,R,T
2RMB0.72
MLEN-METHYLLEUCINEB3CYS0.72
MLEN-METHYLLEUCINEC1CWH0.72
MLEN-METHYLLEUCINEA,B,C,D,E,F,
G,H
3BO70.72
MLEN-METHYLLEUCINEC1CYN0.72
MLEN-METHYLLEUCINEA1LV90.72
MLEN-METHYLLEUCINEC,D2OJU0.72
MLEN-METHYLLEUCINEB,D,F,H,J,L,
N,P,R,T
2RMA0.72
MLEN-METHYLLEUCINEA1IKM0.72
MLEN-METHYLLEUCINEC1CWK0.72
MLEN-METHYLLEUCINEA,B2HG80.72
MLEN-METHYLLEUCINEC1CWB0.72
MLEN-METHYLLEUCINEC1CWJ0.72
MLEN-METHYLLEUCINEA1CYB0.72
MLEN-METHYLLEUCINED1QNG0.72
MLEN-METHYLLEUCINEB1MIK0.72
MLEN-METHYLLEUCINEA1CSA0.72
MLEN-METHYLLEUCINEC1CWL0.72
MLEN-METHYLLEUCINEA1CYA0.72
MLEN-METHYLLEUCINEA,B,D1MF80.72
MLEN-METHYLLEUCINEC1BCK0.72
MLEN-METHYLLEUCINEA,B,D,E,F,H1M630.72
MLEN-METHYLLEUCINEC1CWC0.72
MLEN-METHYLLEUCINEC1CWI0.72
MLEN-METHYLLEUCINEC,D1QNH0.72
MLEN-METHYLLEUCINEB,D,F,H2RMC0.72
MLEN-METHYLLEUCINEC1CWM0.72
MLEN-METHYLLEUCINET,U,V2POY0.72
MLEN-METHYLLEUCINEA,B,C,D,E,F,
I,J,K,L,M,N
2ESL0.72
MLEN-METHYLLEUCINEC1CWO0.72
MLEN-METHYLLEUCINEA1IKL0.72
BG55-HYDROXYAMINO-3-METHYL-PYRROLIDINE-
2-CARBOXYLIC ACID
A1TV20.75
OICOCTAHYDROINDOLE-2-CARBOXYLIC ACIDB,C3BV90.78
OICOCTAHYDROINDOLE-2-CARBOXYLIC ACIDA1BDK0.78
MNL4,N-DIMETHYLNORLEUCINEC1CWC0.77
POMCIS-5-METHYL-4-OXOPROLINEA,B1A7Z0.73
DPL4-OXOPROLINEA,B,C1QFI0.71
SSC(2S,5S)-5-CARBOXYMETHYLPROLINEA,B,C,D1Q190.73
CPI6-CARBOXYPIPERIDINEA,B,C,D,F,Q1EFR0.79
CPI6-CARBOXYPIPERIDINEB1EOL0.79
CPI6-CARBOXYPIPERIDINEB1EOJ0.79
CPI6-CARBOXYPIPERIDINEA,B,C,D,E,F,
G,H,I,J,K,L
1W3M0.79
CPI6-CARBOXYPIPERIDINEA,B2ITK0.79
CPI6-CARBOXYPIPERIDINEA,B2Q5A0.79
LP66-piperidin-1-yl-L-norleucineA,B2W7Z0.7
DPRD-PROLINEP1MCB0.78
DPRD-PROLINEA,B,C,H,K,L2R5B0.78
DPRD-PROLINEA2KDQ0.78
DPRD-PROLINEP1MCS0.78
DPRD-PROLINEA,B2AXI0.78
DPRD-PROLINEA1JY90.78
DPRD-PROLINEA2JUE0.78
DPRD-PROLINEP1MCK0.78
DPRD-PROLINEP1MCR0.78
DPRD-PROLINEA2D550.78
DPRD-PROLINEA1T8J0.78
DPRD-PROLINEA,B2EJ60.78
DPRD-PROLINEP1MCE0.78
DPRD-PROLINEP1MCI0.78
DPRD-PROLINEA,B1SNE0.78
DPRD-PROLINEA,B,C1QFI0.78
DPRD-PROLINEA,P1MCD0.78
DPRD-PROLINEA1ICL0.78
DPRD-PROLINEP1MCQ0.78
DPRD-PROLINEG,M,P,S2I5Y0.78
DPRD-PROLINEA,B,C,D3BOG0.78
DPRD-PROLINEA,L1ZEA0.78
DPRD-PROLINEA,B173D0.78
DPRD-PROLINEA,P1MCJ0.78
DPRD-PROLINEA,B,C1A7Y0.78
DPRD-PROLINEA1IC90.78
DPRD-PROLINEA,B1JY60.78
DPRD-PROLINEA209D0.78
DPRD-PROLINEA1BFW0.78
DPRD-PROLINEA,B1O6I0.78
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
1UNJ0.78
DPRD-PROLINEA,B,C,D2R3C0.78
DPRD-PROLINEA,B,C,D1I3W0.78
DPRD-PROLINEA316D0.78
DPRD-PROLINEA,B,C,D1SN90.78
DPRD-PROLINEA,B,C,H,K,L2R5D0.78
DPRD-PROLINEA,B2Q330.78
DPRD-PROLINEG,M,P,S2I600.78
DPRD-PROLINEA,B1JY40.78
DPRD-PROLINEP1MCF0.78
DPRD-PROLINEA,B,C,D,E,F1UNM0.78
DPRD-PROLINEA1ICO0.78
DPRD-PROLINEA,B1XOF0.78
DPRD-PROLINEP1MCC0.78
DPRD-PROLINEA,B,C,D1SNA0.78
4FB(4S)-4-FLUORO-L-PROLINEA2Q6P0.75
KAI3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINEA1P1N0.71
KAI3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINEA1LBB0.71
KAI3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINEA,B3C340.71
KAI3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINEA1XHY0.71
KAI3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINEA2ANJ0.71
KAI3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINEA,B3C320.71
KAI3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINEA1FTK0.71
KAI3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINEA1GR20.71
KAI3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINEA,B1TT10.71
KAI3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINEA1FW00.71
KAI3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINEA,B3C350.71
KAI3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINEA,B3C360.71
KAI3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINEA,B3C330.71
KAI3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINEA,B3C310.71
KAI3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINEA3EN30.71
IMLN-METHYL-ISOLEUCINEC1CWM0.72