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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01895288

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
SHRN-(5-AMINO-5-CARBOXYPENTYL)GLUTAMIC ACIDA,B,C,D,E,F,
G,H
1E5Q0.73
CPI6-CARBOXYPIPERIDINEA,B,C,D,F,Q1EFR0.72
CPI6-CARBOXYPIPERIDINEB1EOL0.72
CPI6-CARBOXYPIPERIDINEB1EOJ0.72
CPI6-CARBOXYPIPERIDINEA,B,C,D,E,F,
G,H,I,J,K,L
1W3M0.72
CPI6-CARBOXYPIPERIDINEA,B2ITK0.72
CPI6-CARBOXYPIPERIDINEA,B2Q5A0.72
AB52(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2AEB0.7
APP1-ACETYL-2-CARBOXYPIPERIDINEA,B,C,D,F,Q1EFR0.75
AHP2-AMINO-HEPTANOIC ACIDD1J4X0.71
REZ(2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}-
7-OXOHEPTANOIC ACID
A,B2J9P0.78
REZ(2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}-
7-OXOHEPTANOIC ACID
A,B,C,D2VGK0.78
API2,6-DIAMINOPIMELIC ACIDA,B1E8C0.72
API2,6-DIAMINOPIMELIC ACIDA2DAP0.72
API2,6-DIAMINOPIMELIC ACIDE,S148L0.72
DM0N~2~,N~2~,N~6~,N~6~-tetramethyl-
L-lysine
A132L0.84
DOA12-AMINO-DODECANOIC ACIDB1EOJ0.73
DOA12-AMINO-DODECANOIC ACIDA,D1H8T0.73
DOA12-AMINO-DODECANOIC ACIDA2DCX0.73
DOA12-AMINO-DODECANOIC ACIDB1EOL0.73
6CL6-CARBOXYLYSINEU2AIZ0.72
M3LN-TRIMETHYLLYSINEA1YCC0.75
M3LN-TRIMETHYLLYSINEA1FHB0.75
M3LN-TRIMETHYLLYSINEA1CIH0.75
M3LN-TRIMETHYLLYSINET3FDT0.75
M3LN-TRIMETHYLLYSINEB1PDQ0.75
M3LN-TRIMETHYLLYSINEA,B,D,E2V870.75
M3LN-TRIMETHYLLYSINEA,B,C,D,E2V830.75
M3LN-TRIMETHYLLYSINEA2YCC0.75
M3LN-TRIMETHYLLYSINEA1CTY0.75
M3LN-TRIMETHYLLYSINEA1YEA0.75
M3LN-TRIMETHYLLYSINEA,B,C,D2PNX0.75
M3LN-TRIMETHYLLYSINEB,D,F,H3DM10.75
M3LN-TRIMETHYLLYSINEA1CHI0.75
M3LN-TRIMETHYLLYSINEB2H9P0.75
M3LN-TRIMETHYLLYSINEA,P2JMJ0.75
M3LN-TRIMETHYLLYSINEA,B,I,J2P5B0.75
M3LN-TRIMETHYLLYSINEP1KNE0.75
M3LN-TRIMETHYLLYSINEC,D2GFA0.75
M3LN-TRIMETHYLLYSINEA,B,F,G2Q8C0.75
M3LN-TRIMETHYLLYSINEA1CSW0.75
M3LN-TRIMETHYLLYSINED2B2U0.75
M3LN-TRIMETHYLLYSINEA1CHH0.75
M3LN-TRIMETHYLLYSINEA,B,C2VNF0.75
M3LN-TRIMETHYLLYSINEA1IRV0.75
M3LN-TRIMETHYLLYSINEA1CIE0.75
M3LN-TRIMETHYLLYSINEA,B,C,D2B2T0.75
M3LN-TRIMETHYLLYSINEC,D2H6Q0.75
M3LN-TRIMETHYLLYSINEA1CHJ0.75
M3LN-TRIMETHYLLYSINEA1RAQ0.75
M3LN-TRIMETHYLLYSINEA,P2K170.75
M3LN-TRIMETHYLLYSINEA1YEB0.75
M3LN-TRIMETHYLLYSINEA,B,D,E2V850.75
M3LN-TRIMETHYLLYSINEA1YIC0.75
M3LN-TRIMETHYLLYSINEA,B,D,E2V890.75
M3LN-TRIMETHYLLYSINEA1CRG0.75
M3LN-TRIMETHYLLYSINEA1CIF0.75
M3LN-TRIMETHYLLYSINEA1CSU0.75
M3LN-TRIMETHYLLYSINEA,B1UP50.75
M3LN-TRIMETHYLLYSINEA1PRW0.75
M3LN-TRIMETHYLLYSINEA,B3DB30.75
M3LN-TRIMETHYLLYSINEA,B3GL60.75
M3LN-TRIMETHYLLYSINEA1RAP0.75
M3LN-TRIMETHYLLYSINEA1CSV0.75
M3LN-TRIMETHYLLYSINEA1CRJ0.75
M3LN-TRIMETHYLLYSINEA1YFC0.75
M3LN-TRIMETHYLLYSINEA,B,C2H230.75
M3LN-TRIMETHYLLYSINEA,B,C,D2OQ60.75
M3LN-TRIMETHYLLYSINEA,B,C,P2F6J0.75
M3LN-TRIMETHYLLYSINEA,B2KGI0.75
M3LN-TRIMETHYLLYSINEA,B1PFB0.75
M3LN-TRIMETHYLLYSINEA1CTZ0.75
M3LN-TRIMETHYLLYSINEA,C,D,E,L,N,
O,P,W
3CX50.75
M3LN-TRIMETHYLLYSINEA,B,P2YYR0.75
M3LN-TRIMETHYLLYSINEC,D2QQS0.75
M3LN-TRIMETHYLLYSINEB3GV60.75
M3LN-TRIMETHYLLYSINEA,B,C2W9K0.75
M3LN-TRIMETHYLLYSINEA1CCR0.75
M3LN-TRIMETHYLLYSINEA,B2G6Q0.75
M3LN-TRIMETHYLLYSINEA,C,D,E,L,N,
O,P,W
3CXH0.75
M3LN-TRIMETHYLLYSINEA1CRI0.75
M3LN-TRIMETHYLLYSINEA,B,C,D2OS20.75
M3LN-TRIMETHYLLYSINEA,B,D,E2V860.75
M3LN-TRIMETHYLLYSINEA1CRH0.75
M3LN-TRIMETHYLLYSINEA1IRW0.75
M3LN-TRIMETHYLLYSINEA,B,F,G2Q8E0.75
M3LN-TRIMETHYLLYSINEA,B2FUU0.75
M3LN-TRIMETHYLLYSINEA,B2QIC0.75
M3LN-TRIMETHYLLYSINEA1CIG0.75
M3LN-TRIMETHYLLYSINEA1CSX0.75
M3LN-TRIMETHYLLYSINED2B2W0.75
M3LN-TRIMETHYLLYSINEA1YTC0.75
M3LN-TRIMETHYLLYSINEA,P3G7L0.75
M3LN-TRIMETHYLLYSINEC,D,E,N,O,P,W1KYO0.75
M3LN-TRIMETHYLLYSINEA,B,C,D3C6W0.75
LDHN~6~-ETHYL-L-LYSINEA,K2IOF0.73
MNL4,N-DIMETHYLNORLEUCINEC1CWC0.7
MLYN-DIMETHYL-LYSINEB2G9A0.75
MLYN-DIMETHYL-LYSINEB,D2O9K0.75
MLYN-DIMETHYL-LYSINES,V1I840.75
MLYN-DIMETHYL-LYSINEA,B2VD80.75
MLYN-DIMETHYL-LYSINEA,B1YYV0.75
MLYN-DIMETHYL-LYSINEA2R8D0.75
MLYN-DIMETHYL-LYSINEA2RHU0.75
MLYN-DIMETHYL-LYSINEA,B2P4P0.75
MLYN-DIMETHYL-LYSINEC,D2H6N0.75
MLYN-DIMETHYL-LYSINEA,B,P3B950.75
MLYN-DIMETHYL-LYSINEA,B1Z1Y0.75
MLYN-DIMETHYL-LYSINEA,B2QHQ0.75
MLYN-DIMETHYL-LYSINEA2P6V0.75
MLYN-DIMETHYL-LYSINEA,B,D,F2V880.75
MLYN-DIMETHYL-LYSINEC,D2G990.75
MLYN-DIMETHYL-LYSINEA,B2RHI0.75
MLYN-DIMETHYL-LYSINEA,B,C,P2FSA0.75
MLYN-DIMETHYL-LYSINEB,D2RJF0.75
MLYN-DIMETHYL-LYSINEA1VK10.75
MLYN-DIMETHYL-LYSINEA2RHX0.75
MLYN-DIMETHYL-LYSINEA1IV80.75
MLYN-DIMETHYL-LYSINEA,D,G,J,M,P1O1G0.75
MLYN-DIMETHYL-LYSINEA,B,C1XKP0.75
MLYN-DIMETHYL-LYSINEA,B,C2O3F0.75
MLYN-DIMETHYL-LYSINEA2OAI0.75
MLYN-DIMETHYL-LYSINEA2ZPM0.75
MLYN-DIMETHYL-LYSINEA,D,G,J,M,S1O190.75
MLYN-DIMETHYL-LYSINEA,D,G,J,P1O1C0.75
MLYN-DIMETHYL-LYSINEA3EPQ0.75
MLYN-DIMETHYL-LYSINEA,D,G,J,M,P1O180.75
MLYN-DIMETHYL-LYSINEA1LLN0.75
MLYN-DIMETHYL-LYSINEA,D,G,P1M8Q0.75
MLYN-DIMETHYL-LYSINEA,B2G9N0.75
MLYN-DIMETHYL-LYSINEA2R580.75
MLYN-DIMETHYL-LYSINEA,B,C,D,E3HSA0.75
MLYN-DIMETHYL-LYSINEA2ETD0.75
MLYN-DIMETHYL-LYSINEB3C0F0.75
MLYN-DIMETHYL-LYSINEA,D,G,J,M,P1MVW0.75
MLYN-DIMETHYL-LYSINEA,B2MYS0.75
MLYN-DIMETHYL-LYSINEA,D,G,J,M,P1O1E0.75
MLYN-DIMETHYL-LYSINEA,B2PQW0.75
MLYN-DIMETHYL-LYSINEA,D,G,J,M,P1O1D0.75
MLYN-DIMETHYL-LYSINEA,B,C,D,E,F,
G,H
3F9X0.75
MLYN-DIMETHYL-LYSINEA,B,C,D2HO30.75
MLYN-DIMETHYL-LYSINEA,B,F,G2Q8D0.75
MLYN-DIMETHYL-LYSINEA,B,C,D3C8G0.75
MLYN-DIMETHYL-LYSINEA,C2W5Z0.75
MLYN-DIMETHYL-LYSINEA,B,C3EGL0.75
MLYN-DIMETHYL-LYSINEA,B2ETV0.75
MLYN-DIMETHYL-LYSINEA,P2RI70.75
MLYN-DIMETHYL-LYSINEA,B1R1G0.75
MLYN-DIMETHYL-LYSINEA,D,G,J1O1F0.75
MLYN-DIMETHYL-LYSINEA,B,C,D1XL30.75
MLYN-DIMETHYL-LYSINEA132L0.75
MLYN-DIMETHYL-LYSINEA3E3X0.75
MLYN-DIMETHYL-LYSINEA,B2VGX0.75
MLYN-DIMETHYL-LYSINEA,D,G,J1O1B0.75
MLYN-DIMETHYL-LYSINEA2FTZ0.75
MLYN-DIMETHYL-LYSINEA,B,C2VIX0.75
MLYN-DIMETHYL-LYSINEB1GUW0.75
MLYN-DIMETHYL-LYSINEA,B2I6G0.75
MLYN-DIMETHYL-LYSINEA,B2Q7X0.75
MLYN-DIMETHYL-LYSINEA,C,P,Q2RJE0.75
MLYN-DIMETHYL-LYSINEA,B,P,Q2RFI0.75
MLYN-DIMETHYL-LYSINEA,C,P,R2VPE0.75
MLYN-DIMETHYL-LYSINEA,B,C,D3HHL0.75
MLYN-DIMETHYL-LYSINEP2CNX0.75
MLYN-DIMETHYL-LYSINEA2VGY0.75
MLYN-DIMETHYL-LYSINEA,B2VJ40.75
MLYN-DIMETHYL-LYSINEA2FCL0.75
MLYN-DIMETHYL-LYSINE2,3,48KME0.75
MLYN-DIMETHYL-LYSINEA,B,C,D2F4I0.75
MLYN-DIMETHYL-LYSINEA,B2PX80.75
MLYN-DIMETHYL-LYSINEA,B2VD90.75
MLYN-DIMETHYL-LYSINEA,B2QJV0.75
MLYN-DIMETHYL-LYSINEA,C,P,R2VPG0.75
MLYN-DIMETHYL-LYSINEA,B3BED0.75
MLYN-DIMETHYL-LYSINEA3GS90.75
MLYN-DIMETHYL-LYSINEA,D,G,J,M,P1O1A0.75
MLYN-DIMETHYL-LYSINEA,B2IG00.75
MLYN-DIMETHYL-LYSINEP1KNA0.75
MLYN-DIMETHYL-LYSINEB2H130.75
MLYN-DIMETHYL-LYSINEA,B,C,D2OX00.75
NPI2-AMINOPIMELIC ACIDA2TDT0.74
NPI2-AMINOPIMELIC ACIDA1KGQ0.74
NSKN-SUCCINYL LYSINEA2P8B0.7
DNMN-METHYL-D-NORLEUCINEA,B1S1O0.73
DNMN-METHYL-D-NORLEUCINEA,B1S4A0.73
DNMN-METHYL-D-NORLEUCINEA1R9V0.73
LYPN~6~-METHYL-N~6~-PROPYL-L-LYSINEA,E2UXN0.76
DIQ2-METHYL-DECAHYDRO-ISOQUINOLINE-
3-CARBOXYLIC ACID
A,B1HXB0.71
DIQ2-METHYL-DECAHYDRO-ISOQUINOLINE-
3-CARBOXYLIC ACID
A,B2FGU0.71
DIQ2-METHYL-DECAHYDRO-ISOQUINOLINE-
3-CARBOXYLIC ACID
A,B2FGV0.71
DIQ2-METHYL-DECAHYDRO-ISOQUINOLINE-
3-CARBOXYLIC ACID
A,B1MTB0.71
DLSDI-ACETYL-LYSINEA,B,C,D,E,F1FVM0.73
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
LLYNZ-(DICARBOXYMETHYL)LYSINEA,B1UCW0.75
PBE1,1-DIMETHYL-PROLINIUMA,B2B4M0.7
PBE1,1-DIMETHYL-PROLINIUMA1R9Q0.7
PBE1,1-DIMETHYL-PROLINIUMA,B1SW10.7
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B1O5K0.78
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B3CPR0.78
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B2VC60.78
HHK(2S)-2,8-DIAMINOOCTANOIC ACIDA1XY80.73
REXGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANYL-D-ALANINE
A1IKG0.75
LP66-piperidin-1-yl-L-norleucineA,B2W7Z0.74
SSC(2S,5S)-5-CARBOXYMETHYLPROLINEA,B,C,D1Q190.72
OCBOCTANOYLCARNITINEA,B1XL80.72
REYGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANINE
A1IKI0.76