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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00483197

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DNGN-FORMYL-D-NORLEUCINEA,B1S4A0.7
X7O5-AMINO-3-METHYL-PYRROLIDINE-2-
CARBOXYLIC ACID
A1L2Q0.72
MHLN-METHYL-4-HYDROXY-LEUCINEC1CWL0.74
DLED-LEUCINEA,B1ALZ0.72
DLED-LEUCINEA,B1BDW0.72
DLED-LEUCINEA,D1CZQ0.72
DLED-LEUCINEA1BFW0.72
DLED-LEUCINEE,F,G,H1XN20.72
DLED-LEUCINEA,B,C,D1GMK0.72
DLED-LEUCINEA,B1TKQ0.72
DLED-LEUCINEA,B,C,H,K,L2R5D0.72
DLED-LEUCINEA2NPV0.72
DLED-LEUCINEA,B,C,D2R3C0.72
DLED-LEUCINEB,D,E1AFQ0.72
DLED-LEUCINEA,B1MIC0.72
DLED-LEUCINEA,B1NRU0.72
DLED-LEUCINEA,B1JNO0.72
DLED-LEUCINEA,B1GRM0.72
DLED-LEUCINEA,B1NRM0.72
DLED-LEUCINEA,D2Q3I0.72
DLED-LEUCINEA,B1NT50.72
DLED-LEUCINEA2JUE0.72
DLED-LEUCINEA,B,C,D1AV20.72
DLED-LEUCINEA1YY20.72
DLED-LEUCINEA,B1AL40.72
DLED-LEUCINEA,B1NG80.72
DLED-LEUCINEA,B1ALX0.72
DLED-LEUCINEA,B1JO40.72
DLED-LEUCINEA,B,C,H,K,L2R5B0.72
DLED-LEUCINEA,B1MAG0.72
DLED-LEUCINEA,B1NT60.72
DLED-LEUCINEA,B2Q330.72
DLED-LEUCINEA,B1JO30.72
DLED-LEUCINEE,I1BLL0.72
DLED-LEUCINEA,B1KQE0.72
DLED-LEUCINEA,B,C,D1W5U0.72
DLED-LEUCINEA,B,C,D2IZQ0.72
DLED-LEUCINEA1C4B0.72
DLED-LEUCINEA,B,C,D1C4D0.72
MVAN-METHYLVALINEA209D0.77
MVAN-METHYLVALINEA,B,C,D,E,F,
G,H
3BO70.77
MVAN-METHYLVALINEC1CWH0.77
MVAN-METHYLVALINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V,W,X
1UNJ0.77
MVAN-METHYLVALINEA1DSD0.77
MVAN-METHYLVALINEB1L1V0.77
MVAN-METHYLVALINEA,B,C,D,E,F,
I,J,K,L,M,N
2ESL0.77
MVAN-METHYLVALINEB,D,F,H,J,L,
N,P,R,T
2RMB0.77
MVAN-METHYLVALINEC1CWO0.77
MVAN-METHYLVALINEC1CWL0.77
MVAN-METHYLVALINEB1MIK0.77
MVAN-METHYLVALINEA1CSA0.77
MVAN-METHYLVALINEC1CWM0.77
MVAN-METHYLVALINEA1PFE0.77
MVAN-METHYLVALINEA,B,D,E,F,H1M630.77
MVAN-METHYLVALINEC1CWC0.77
MVAN-METHYLVALINEB,D,F,H2RMC0.77
MVAN-METHYLVALINEC1CWK0.77
MVAN-METHYLVALINEC1CYN0.77
MVAN-METHYLVALINEC,D1MNV0.77
MVAN-METHYLVALINEC,D2OJU0.77
MVAN-METHYLVALINEB,D,F,H,J,L,
N,P,R,T
2RMA0.77
MVAN-METHYLVALINEA1CYB0.77
MVAN-METHYLVALINED1QNG0.77
MVAN-METHYLVALINEA,C,E,G2ADW0.77
MVAN-METHYLVALINEC1CWB0.77
MVAN-METHYLVALINEA,B,C,D,E,F1UNM0.77
MVAN-METHYLVALINEA,B1OVF0.77
MVAN-METHYLVALINEA,B185D0.77
MVAN-METHYLVALINEA1XVK0.77
MVAN-METHYLVALINEA,C1XVR0.77
MVAN-METHYLVALINEA,B173D0.77
MVAN-METHYLVALINEA,B1FJA0.77
MVAN-METHYLVALINEB3CYS0.77
MVAN-METHYLVALINEA,B,C1A7Y0.77
MVAN-METHYLVALINEA,B,C1L5G0.77
MVAN-METHYLVALINEA,B,C,D1I3W0.77
MVAN-METHYLVALINEA316D0.77
MVAN-METHYLVALINEA1XVN0.77
MVAN-METHYLVALINEC1IKF0.77
MVAN-METHYLVALINEA,M,N2Z6W0.77
MVAN-METHYLVALINEA,B,C1QFI0.77
MVAN-METHYLVALINEA,B3GO30.77
MVAN-METHYLVALINEC1CWA0.77
MVAN-METHYLVALINEC1CWF0.77
MVAN-METHYLVALINEB,D,F,H,J,L,
N,P
1C5F0.77
MVAN-METHYLVALINED,E,F1XQ70.77
MVAN-METHYLVALINEA1CYA0.77
MVAN-METHYLVALINEA,B,D1MF80.77
MVAN-METHYLVALINEA,B1A7Z0.77
MVAN-METHYLVALINEA1DSC0.77
MVAN-METHYLVALINET,U,V2POY0.77
MVAN-METHYLVALINEA2D550.77
MVAN-METHYLVALINEC1BCK0.77
MVAN-METHYLVALINEC1CWI0.77
MVAN-METHYLVALINEC,D1QNH0.77
MVAN-METHYLVALINEA1VS20.77
INC2-(ACETYL-HYDROXY-AMINO)-4-METHYL-
PENTANOIC ACID METHYL ESTER
A7TLN0.73
MLLMETHYL L-LEUCINATEC,F,M,N2IAE0.81
MCP2-CARBOXY-4-METHYLPIPERIDINEH1ETR0.74
DNMN-METHYL-D-NORLEUCINEA,B1S1O0.73
DNMN-METHYL-D-NORLEUCINEA,B1S4A0.73
DNMN-METHYL-D-NORLEUCINEA1R9V0.73
0AGN-(ethoxycarbonyl)-L-leucineI,J1PSA0.8
MLEN-METHYLLEUCINEA,D2J9A0.82
MLEN-METHYLLEUCINEC1IKF0.82
MLEN-METHYLLEUCINEA,M,N2Z6W0.82
MLEN-METHYLLEUCINEB,D,F,H,J,L,
N,P
1C5F0.82
MLEN-METHYLLEUCINED,E,F1XQ70.82
MLEN-METHYLLEUCINEC1CWA0.82
MLEN-METHYLLEUCINEC1CWF0.82
MLEN-METHYLLEUCINEB,D,F,H,J,L,
N,P,R,T
2RMB0.82
MLEN-METHYLLEUCINEB3CYS0.82
MLEN-METHYLLEUCINEC1CWH0.82
MLEN-METHYLLEUCINEA,B,C,D,E,F,
G,H
3BO70.82
MLEN-METHYLLEUCINEC1CYN0.82
MLEN-METHYLLEUCINEA1LV90.82
MLEN-METHYLLEUCINEC,D2OJU0.82
MLEN-METHYLLEUCINEB,D,F,H,J,L,
N,P,R,T
2RMA0.82
MLEN-METHYLLEUCINEA1IKM0.82
MLEN-METHYLLEUCINEC1CWK0.82
MLEN-METHYLLEUCINEA,B2HG80.82
MLEN-METHYLLEUCINEC1CWB0.82
MLEN-METHYLLEUCINEC1CWJ0.82
MLEN-METHYLLEUCINEA1CYB0.82
MLEN-METHYLLEUCINED1QNG0.82
MLEN-METHYLLEUCINEB1MIK0.82
MLEN-METHYLLEUCINEA1CSA0.82
MLEN-METHYLLEUCINEC1CWL0.82
MLEN-METHYLLEUCINEA1CYA0.82
MLEN-METHYLLEUCINEA,B,D1MF80.82
MLEN-METHYLLEUCINEC1BCK0.82
MLEN-METHYLLEUCINEA,B,D,E,F,H1M630.82
MLEN-METHYLLEUCINEC1CWC0.82
MLEN-METHYLLEUCINEC1CWI0.82
MLEN-METHYLLEUCINEC,D1QNH0.82
MLEN-METHYLLEUCINEB,D,F,H2RMC0.82
MLEN-METHYLLEUCINEC1CWM0.82
MLEN-METHYLLEUCINET,U,V2POY0.82
MLEN-METHYLLEUCINEA,B,C,D,E,F,
I,J,K,L,M,N
2ESL0.82
MLEN-METHYLLEUCINEC1CWO0.82
MLEN-METHYLLEUCINEA1IKL0.82
MLZN-METHYL-LYSINEA,B,I,J2PXJ0.7
MLZN-METHYL-LYSINEA,B,E,F1XQH0.7
MLZN-METHYL-LYSINEA,B,C,D2G460.7
MLZN-METHYL-LYSINED2B2V0.7
MLZN-METHYL-LYSINEA,B3CBM0.7
MLZN-METHYL-LYSINEA,B,C,D2OT70.7
MLZN-METHYL-LYSINEA,B,E,F3F9Y0.7
MLZN-METHYL-LYSINEP1Q3L0.7
MLZN-METHYL-LYSINEA,B,E,F2BQZ0.7
MLZN-METHYL-LYSINEA2RHY0.7
MLZN-METHYL-LYSINEA,B2F690.7
MLZN-METHYL-LYSINEA2R5A0.7
MLZN-METHYL-LYSINEA,B3F700.7
MLZN-METHYL-LYSINEA,B,C2H2J0.7
MLZN-METHYL-LYSINEC,D2H6K0.7
MLZN-METHYL-LYSINEA3EPQ0.7
MLZN-METHYL-LYSINEA,B2QNU0.7
MLZN-METHYL-LYSINEA,B,C,D3HHL0.7
MLZN-METHYL-LYSINEA1IV80.7
MLZN-METHYL-LYSINEA1XER0.7
MLZN-METHYL-LYSINEB,D2H9N0.7
MLZN-METHYL-LYSINEL2R5M0.7
MLZN-METHYL-LYSINEA3E3X0.7
MLZN-METHYL-LYSINEA,B2VYT0.7
MLZN-METHYL-LYSINEA,B,K,L1O9S0.7
MLZN-METHYL-LYSINEA,B,C1P0Y0.7
MLZN-METHYL-LYSINEA,B3CBO0.7
NLOO-METHYL-L-NORLEUCINEA,B1S4A0.72
MNL4,N-DIMETHYLNORLEUCINEC1CWC0.82
VMEMETHYL L-VALINATEA,B,C2JE40.75
VMEMETHYL L-VALINATEA,B,C2J9J0.75
VMEMETHYL L-VALINATEA,B,C7HVP0.75
BG1O-[(2S)-2-{methyl[(methylamino)sulfonyl]amino}pentanoyl]-
L-serine
A2RG30.73
IMLN-METHYL-ISOLEUCINEC1CWM0.86
0AAmethyl L-valinateI1HEF0.75
TMD(6,7-DIHYDRO)4-[(E)-BUTENYL]-4,N-
DIMETHYL-THREONINE
C1CWK0.71
DILD-ISOLEUCINEA,B2Q330.75
DILD-ISOLEUCINEA1CWZ0.75
DILD-ISOLEUCINEA1CVQ0.75
DILD-ISOLEUCINEA1C4B0.75
DILD-ISOLEUCINEA1CW80.75
DILD-ISOLEUCINEA2AP80.75
IILISO-ISOLEUCINEA,B,C,D1Q4V0.75
IILISO-ISOLEUCINEA1KMF0.75
IILISO-ISOLEUCINEA,B,C1TGG0.75
IILISO-ISOLEUCINEA1RH40.75
AN0N-ACETYL-L-NORVALINEC,D,E,X,Y,Z2G7M0.72
AN0N-ACETYL-L-NORVALINEA1ZQ80.72
LDHN~6~-ETHYL-L-LYSINEA,K2IOF0.71
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B1O5K0.73
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B3CPR0.73
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B2VC60.73
CPC2-METHYL-1-METHYLAMINO-CYCLOPROPANE CARBOXYLIC ACIDC,D193D0.76