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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00485204

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
MNL4,N-DIMETHYLNORLEUCINEC1CWC0.75
SSC(2S,5S)-5-CARBOXYMETHYLPROLINEA,B,C,D1Q190.8
BG55-HYDROXYAMINO-3-METHYL-PYRROLIDINE-
2-CARBOXYLIC ACID
A1TV20.7
CPV5-AMINO-6-CYCLOHEXYL-4-HYDROXY-
2-ISOPROPYL-HEXANOIC ACID
I1IVQ0.7
RPH6-HYDROXO-OCTAHYDRO-INDOLE-2-CARBALDEHYDEH,I1A2C0.83
LY5(3S,4aR,6S,8aR)-6-{[(2S)-2-carboxy-
4,4-difluoropyrrolidin-1-yl]methyl}decahydroisoquinoline-
3-carboxylic acid
A,B,C,D2QS40.74
MCP2-CARBOXY-4-METHYLPIPERIDINEH1ETR0.75
TMD(6,7-DIHYDRO)4-[(E)-BUTENYL]-4,N-
DIMETHYL-THREONINE
C1CWK0.72
4FB(4S)-4-FLUORO-L-PROLINEA2Q6P0.71
POMCIS-5-METHYL-4-OXOPROLINEA,B1A7Z0.73
OICOCTAHYDROINDOLE-2-CARBOXYLIC ACIDB,C3BV91
OICOCTAHYDROINDOLE-2-CARBOXYLIC ACIDA1BDK1
ABX5-[1-(ACETYLAMINO)-3-METHYLBUTYL]-
4-(METHOXYCARBONYL)PROLINE
A1XOE0.72
X7O5-AMINO-3-METHYL-PYRROLIDINE-2-
CARBOXYLIC ACID
A1L2Q0.73
NLH(2R,5S)-5-amino-2-butyl-4,4-dihydroxynonanoic acidA,B,I3DCR0.71
ZAL3-cyclohexyl-D-alanineI1HBT0.76
NLK(2R,5S)-5-amino-2-butyl-4-oxononanoic acidA,B,I3DCK0.71
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D5Z0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,I5GDS0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,P2A2X0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H2FEQ0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,P2ANK0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,C,D3DPP0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA1EB10.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H1NZQ0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1HBT0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D6E0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B1B3H0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H2FES0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDC,D,E,G,H3DPQ0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1THS0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1QUR0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B,C,D3DPO0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,I4THN0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,D1D5M0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H1O0D0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
1YWH0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA1XRZ0.76
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D5X0.76
CHGCYCLOHEXYL-GLYCINE2,3,48KME0.77
CHGCYCLOHEXYL-GLYCINEH,I4THN0.77
CHGCYCLOHEXYL-GLYCINEH,I,J7KME0.77
CHGCYCLOHEXYL-GLYCINEH,I5GDS0.77
DPRD-PROLINEP1MCB0.73
DPRD-PROLINEA,B,C,H,K,L2R5B0.73
DPRD-PROLINEA2KDQ0.73
DPRD-PROLINEP1MCS0.73
DPRD-PROLINEA,B2AXI0.73
DPRD-PROLINEA1JY90.73
DPRD-PROLINEA2JUE0.73
DPRD-PROLINEP1MCK0.73
DPRD-PROLINEP1MCR0.73
DPRD-PROLINEA2D550.73
DPRD-PROLINEA1T8J0.73
DPRD-PROLINEA,B2EJ60.73
DPRD-PROLINEP1MCE0.73
DPRD-PROLINEP1MCI0.73
DPRD-PROLINEA,B1SNE0.73
DPRD-PROLINEA,B,C1QFI0.73
DPRD-PROLINEA,P1MCD0.73
DPRD-PROLINEA1ICL0.73
DPRD-PROLINEP1MCQ0.73
DPRD-PROLINEG,M,P,S2I5Y0.73
DPRD-PROLINEA,B,C,D3BOG0.73
DPRD-PROLINEA,L1ZEA0.73
DPRD-PROLINEA,B173D0.73
DPRD-PROLINEA,P1MCJ0.73
DPRD-PROLINEA,B,C1A7Y0.73
DPRD-PROLINEA1IC90.73
DPRD-PROLINEA,B1JY60.73
DPRD-PROLINEA209D0.73
DPRD-PROLINEA1BFW0.73
DPRD-PROLINEA,B1O6I0.73
DPRD-PROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V,W,X
1UNJ0.73
DPRD-PROLINEA,B,C,D2R3C0.73
DPRD-PROLINEA,B,C,D1I3W0.73
DPRD-PROLINEA316D0.73
DPRD-PROLINEA,B,C,D1SN90.73
DPRD-PROLINEA,B,C,H,K,L2R5D0.73
DPRD-PROLINEA,B2Q330.73
DPRD-PROLINEG,M,P,S2I600.73
DPRD-PROLINEA,B1JY40.73
DPRD-PROLINEP1MCF0.73
DPRD-PROLINEA,B,C,D,E,F1UNM0.73
DPRD-PROLINEA1ICO0.73
DPRD-PROLINEA,B1XOF0.73
DPRD-PROLINEP1MCC0.73
DPRD-PROLINEA,B,C,D1SNA0.73