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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03032883

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
OICOCTAHYDROINDOLE-2-CARBOXYLIC ACIDB,C3BV90.73
OICOCTAHYDROINDOLE-2-CARBOXYLIC ACIDA1BDK0.73
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D5Z0.74
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,I5GDS0.74
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,P2A2X0.74
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H2FEQ0.74
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,P2ANK0.74
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,C,D3DPP0.74
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA1EB10.74
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H1NZQ0.74
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1HBT0.74
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D6E0.74
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B1B3H0.74
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H2FES0.74
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDC,D,E,G,H3DPQ0.74
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1THS0.74
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1QUR0.74
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B,C,D3DPO0.74
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,I4THN0.74
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,D1D5M0.74
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H1O0D0.74
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
1YWH0.74
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA1XRZ0.74
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D5X0.74
DIQ2-METHYL-DECAHYDRO-ISOQUINOLINE-
3-CARBOXYLIC ACID
A,B1HXB0.72
DIQ2-METHYL-DECAHYDRO-ISOQUINOLINE-
3-CARBOXYLIC ACID
A,B2FGU0.72
DIQ2-METHYL-DECAHYDRO-ISOQUINOLINE-
3-CARBOXYLIC ACID
A,B2FGV0.72
DIQ2-METHYL-DECAHYDRO-ISOQUINOLINE-
3-CARBOXYLIC ACID
A,B1MTB0.72
TMD(6,7-DIHYDRO)4-[(E)-BUTENYL]-4,N-
DIMETHYL-THREONINE
C1CWK0.73
ZAL3-cyclohexyl-D-alanineI1HBT0.74
REZ(2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}-
7-OXOHEPTANOIC ACID
A,B2J9P0.73
REZ(2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}-
7-OXOHEPTANOIC ACID
A,B,C,D2VGK0.73
CYJ(Z)-N~6~-[(4R,5S)-5-(2-CARBOXYETHYL)-
4-(CARBOXYMETHYL)PIPERIDIN-3-YLIDENE]-
L-LYSINE
A,B2C140.74
MNL4,N-DIMETHYLNORLEUCINEC1CWC0.78
CPI6-CARBOXYPIPERIDINEA,B,C,D,F,Q1EFR0.75
CPI6-CARBOXYPIPERIDINEB1EOL0.75
CPI6-CARBOXYPIPERIDINEB1EOJ0.75
CPI6-CARBOXYPIPERIDINEA,B,C,D,E,F,
G,H,I,J,K,L
1W3M0.75
CPI6-CARBOXYPIPERIDINEA,B2ITK0.75
CPI6-CARBOXYPIPERIDINEA,B2Q5A0.75
MCP2-CARBOXY-4-METHYLPIPERIDINEH1ETR0.81
REXGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANYL-D-ALANINE
A1IKG0.7
CHGCYCLOHEXYL-GLYCINE2,3,48KME0.73
CHGCYCLOHEXYL-GLYCINEH,I4THN0.73
CHGCYCLOHEXYL-GLYCINEH,I,J7KME0.73
CHGCYCLOHEXYL-GLYCINEH,I5GDS0.73
1PI3-(1-CARBAMIMIDOYL-PIPERIDIN-3-
YL)-L-ALANINE
A,B1ZZZ0.71
LP66-piperidin-1-yl-L-norleucineA,B2W7Z0.72
LLYNZ-(DICARBOXYMETHYL)LYSINEA,B1UCW0.7
3GA3-PIPERIDYL-N-GUANIDINO-L-ALANINEB,C1BB00.71
3GA3-PIPERIDYL-N-GUANIDINO-L-ALANINE11YYY0.71
3GA3-PIPERIDYL-N-GUANIDINO-L-ALANINEB,C1CA80.71
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B1O5K0.73
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B3CPR0.73
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B2VC60.73
RE1GLYCYL-L-A-AMINOPIMELYL-E-(D-2-
AMINOETHYL)PHOSPHONATE
A1MPL0.78
REYGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANINE
A1IKI0.71