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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03209197

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
REXGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANYL-D-ALANINE
A1IKG0.71
CYJ(Z)-N~6~-[(4R,5S)-5-(2-CARBOXYETHYL)-
4-(CARBOXYMETHYL)PIPERIDIN-3-YLIDENE]-
L-LYSINE
A,B2C140.77
1PI3-(1-CARBAMIMIDOYL-PIPERIDIN-3-
YL)-L-ALANINE
A,B1ZZZ0.72
DIQ2-METHYL-DECAHYDRO-ISOQUINOLINE-
3-CARBOXYLIC ACID
A,B1HXB0.77
DIQ2-METHYL-DECAHYDRO-ISOQUINOLINE-
3-CARBOXYLIC ACID
A,B2FGU0.77
DIQ2-METHYL-DECAHYDRO-ISOQUINOLINE-
3-CARBOXYLIC ACID
A,B2FGV0.77
DIQ2-METHYL-DECAHYDRO-ISOQUINOLINE-
3-CARBOXYLIC ACID
A,B1MTB0.77
LY5(3S,4aR,6S,8aR)-6-{[(2S)-2-carboxy-
4,4-difluoropyrrolidin-1-yl]methyl}decahydroisoquinoline-
3-carboxylic acid
A,B,C,D2QS40.74
REYGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANINE
A1IKI0.72
CHGCYCLOHEXYL-GLYCINE2,3,48KME0.76
CHGCYCLOHEXYL-GLYCINEH,I4THN0.76
CHGCYCLOHEXYL-GLYCINEH,I,J7KME0.76
CHGCYCLOHEXYL-GLYCINEH,I5GDS0.76
LLYNZ-(DICARBOXYMETHYL)LYSINEA,B1UCW0.71
3GA3-PIPERIDYL-N-GUANIDINO-L-ALANINEB,C1BB00.72
3GA3-PIPERIDYL-N-GUANIDINO-L-ALANINE11YYY0.72
3GA3-PIPERIDYL-N-GUANIDINO-L-ALANINEB,C1CA80.72
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D5Z0.78
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,I5GDS0.78
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,P2A2X0.78
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H2FEQ0.78
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,P2ANK0.78
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,C,D3DPP0.78
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA1EB10.78
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H1NZQ0.78
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1HBT0.78
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D6E0.78
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B1B3H0.78
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H2FES0.78
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDC,D,E,G,H3DPQ0.78
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1THS0.78
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1QUR0.78
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B,C,D3DPO0.78
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,I4THN0.78
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,D1D5M0.78
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H1O0D0.78
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
1YWH0.78
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA1XRZ0.78
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D5X0.78
REZ(2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}-
7-OXOHEPTANOIC ACID
A,B2J9P0.74
REZ(2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}-
7-OXOHEPTANOIC ACID
A,B,C,D2VGK0.74
LP66-piperidin-1-yl-L-norleucineA,B2W7Z0.72
AMHTRANS-4-AMINOMETHYLCYCLOHEXANE-
1-CARBOXYLIC ACID
A,B1CEB0.71
AMHTRANS-4-AMINOMETHYLCYCLOHEXANE-
1-CARBOXYLIC ACID
A1B2I0.71
CPI6-CARBOXYPIPERIDINEA,B,C,D,F,Q1EFR0.76
CPI6-CARBOXYPIPERIDINEB1EOL0.76
CPI6-CARBOXYPIPERIDINEB1EOJ0.76
CPI6-CARBOXYPIPERIDINEA,B,C,D,E,F,
G,H,I,J,K,L
1W3M0.76
CPI6-CARBOXYPIPERIDINEA,B2ITK0.76
CPI6-CARBOXYPIPERIDINEA,B2Q5A0.76
OICOCTAHYDROINDOLE-2-CARBOXYLIC ACIDB,C3BV90.76
OICOCTAHYDROINDOLE-2-CARBOXYLIC ACIDA1BDK0.76
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B1O5K0.74
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B3CPR0.74
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B2VC60.74
TMD(6,7-DIHYDRO)4-[(E)-BUTENYL]-4,N-
DIMETHYL-THREONINE
C1CWK0.76
MCP2-CARBOXY-4-METHYLPIPERIDINEH1ETR0.82
MNL4,N-DIMETHYLNORLEUCINEC1CWC0.79
IKT3-(1-AMINOETHYL)NONANEDIOIC ACIDA1DAE0.72