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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00022700

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
MNL4,N-DIMETHYLNORLEUCINEC1CWC0.75
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
TMD(6,7-DIHYDRO)4-[(E)-BUTENYL]-4,N-
DIMETHYL-THREONINE
C1CWK0.75
REYGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANINE
A1IKI0.73
ZAL3-cyclohexyl-D-alanineI1HBT0.74
DAA8-AMINO-7-CARBOXYAMINO-NONANOIC ACID WITH ALUMINUM FLUORIDEA1BS10.71
DLSDI-ACETYL-LYSINEA,B,C,D,E,F1FVM0.71
REZ(2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}-
7-OXOHEPTANOIC ACID
A,B2J9P0.75
REZ(2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}-
7-OXOHEPTANOIC ACID
A,B,C,D2VGK0.75
OICOCTAHYDROINDOLE-2-CARBOXYLIC ACIDB,C3BV90.7
OICOCTAHYDROINDOLE-2-CARBOXYLIC ACIDA1BDK0.7
LBYN~6~-(TERT-BUTOXYCARBONYL)-L-LYSINEA2ZIN0.78
CHGCYCLOHEXYL-GLYCINE2,3,48KME0.73
CHGCYCLOHEXYL-GLYCINEH,I4THN0.73
CHGCYCLOHEXYL-GLYCINEH,I,J7KME0.73
CHGCYCLOHEXYL-GLYCINEH,I5GDS0.73
MCP2-CARBOXY-4-METHYLPIPERIDINEH1ETR0.71
DSD7-(CARBOXYAMINO)-8-AMINO-NONANOIC ACIDA1DAG0.72
DSD7-(CARBOXYAMINO)-8-AMINO-NONANOIC ACIDA1DAF0.72
DSD7-(CARBOXYAMINO)-8-AMINO-NONANOIC ACIDA,B,C,D3FMF0.72
DSD7-(CARBOXYAMINO)-8-AMINO-NONANOIC ACIDA1DAI0.72
REXGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANYL-D-ALANINE
A1IKG0.72
TCOTERT-BUTYL(1S)-1-CYCLOHEXYL-2-OXOETHYLCARBAMATEA1Q6K0.84
0AGN-(ethoxycarbonyl)-L-leucineI,J1PSA0.76
DH9(2S,3S,5S)-5-[(N-FORMYL-L-LEUCYL)OXY]-
2-HEXYL-3-HYDROXYHEXADECANOIC ACID
A,B2PX60.7