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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03099469

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
0AGN-(ethoxycarbonyl)-L-leucineI,J1PSA0.73
HTFN-(2-OXOTETRAHYDROFURAN-3-YL)OCTANAMIDEA2AVX0.73
MCP2-CARBOXY-4-METHYLPIPERIDINEH1ETR0.7
MLEN-METHYLLEUCINEA,D2J9A0.75
MLEN-METHYLLEUCINEC1IKF0.75
MLEN-METHYLLEUCINEA,M,N2Z6W0.75
MLEN-METHYLLEUCINEB,D,F,H,J,L,
N,P
1C5F0.75
MLEN-METHYLLEUCINED,E,F1XQ70.75
MLEN-METHYLLEUCINEC1CWA0.75
MLEN-METHYLLEUCINEC1CWF0.75
MLEN-METHYLLEUCINEB,D,F,H,J,L,
N,P,R,T
2RMB0.75
MLEN-METHYLLEUCINEB3CYS0.75
MLEN-METHYLLEUCINEC1CWH0.75
MLEN-METHYLLEUCINEA,B,C,D,E,F,
G,H
3BO70.75
MLEN-METHYLLEUCINEC1CYN0.75
MLEN-METHYLLEUCINEA1LV90.75
MLEN-METHYLLEUCINEC,D2OJU0.75
MLEN-METHYLLEUCINEB,D,F,H,J,L,
N,P,R,T
2RMA0.75
MLEN-METHYLLEUCINEA1IKM0.75
MLEN-METHYLLEUCINEC1CWK0.75
MLEN-METHYLLEUCINEA,B2HG80.75
MLEN-METHYLLEUCINEC1CWB0.75
MLEN-METHYLLEUCINEC1CWJ0.75
MLEN-METHYLLEUCINEA1CYB0.75
MLEN-METHYLLEUCINED1QNG0.75
MLEN-METHYLLEUCINEB1MIK0.75
MLEN-METHYLLEUCINEA1CSA0.75
MLEN-METHYLLEUCINEC1CWL0.75
MLEN-METHYLLEUCINEA1CYA0.75
MLEN-METHYLLEUCINEA,B,D1MF80.75
MLEN-METHYLLEUCINEC1BCK0.75
MLEN-METHYLLEUCINEA,B,D,E,F,H1M630.75
MLEN-METHYLLEUCINEC1CWC0.75
MLEN-METHYLLEUCINEC1CWI0.75
MLEN-METHYLLEUCINEC,D1QNH0.75
MLEN-METHYLLEUCINEB,D,F,H2RMC0.75
MLEN-METHYLLEUCINEC1CWM0.75
MLEN-METHYLLEUCINET,U,V2POY0.75
MLEN-METHYLLEUCINEA,B,C,D,E,F,
I,J,K,L,M,N
2ESL0.75
MLEN-METHYLLEUCINEC1CWO0.75
MLEN-METHYLLEUCINEA1IKL0.75
X7O5-AMINO-3-METHYL-PYRROLIDINE-2-
CARBOXYLIC ACID
A1L2Q0.78
0AZ(4R)-4-hydroxy-L-prolineA1GQ00.74
BG45-(HYDROXY-METHYL-AMINO)-3-METHYL-
PYRROLIDINE-2-CARBOXYLIC ACID
A1TV30.73
BG55-HYDROXYAMINO-3-METHYL-PYRROLIDINE-
2-CARBOXYLIC ACID
A1TV20.75
4FB(4S)-4-FLUORO-L-PROLINEA2Q6P0.76
MNL4,N-DIMETHYLNORLEUCINEC1CWC0.72
DPL4-OXOPROLINEA,B,C1QFI0.71
DPRD-PROLINEP1MCB0.78
DPRD-PROLINEA,B,C,H,K,L2R5B0.78
DPRD-PROLINEA2KDQ0.78
DPRD-PROLINEP1MCS0.78
DPRD-PROLINEA,B2AXI0.78
DPRD-PROLINEA1JY90.78
DPRD-PROLINEA2JUE0.78
DPRD-PROLINEP1MCK0.78
DPRD-PROLINEP1MCR0.78
DPRD-PROLINEA2D550.78
DPRD-PROLINEA1T8J0.78
DPRD-PROLINEA,B2EJ60.78
DPRD-PROLINEP1MCE0.78
DPRD-PROLINEP1MCI0.78
DPRD-PROLINEA,B1SNE0.78
DPRD-PROLINEA,B,C1QFI0.78
DPRD-PROLINEA,P1MCD0.78
DPRD-PROLINEA1ICL0.78
DPRD-PROLINEP1MCQ0.78
DPRD-PROLINEG,M,P,S2I5Y0.78
DPRD-PROLINEA,B,C,D3BOG0.78
DPRD-PROLINEA,L1ZEA0.78
DPRD-PROLINEA,B173D0.78
DPRD-PROLINEA,P1MCJ0.78
DPRD-PROLINEA,B,C1A7Y0.78
DPRD-PROLINEA1IC90.78
DPRD-PROLINEA,B1JY60.78
DPRD-PROLINEA209D0.78
DPRD-PROLINEA1BFW0.78
DPRD-PROLINEA,B1O6I0.78
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
1UNJ0.78
DPRD-PROLINEA,B,C,D2R3C0.78
DPRD-PROLINEA,B,C,D1I3W0.78
DPRD-PROLINEA316D0.78
DPRD-PROLINEA,B,C,D1SN90.78
DPRD-PROLINEA,B,C,H,K,L2R5D0.78
DPRD-PROLINEA,B2Q330.78
DPRD-PROLINEG,M,P,S2I600.78
DPRD-PROLINEA,B1JY40.78
DPRD-PROLINEP1MCF0.78
DPRD-PROLINEA,B,C,D,E,F1UNM0.78
DPRD-PROLINEA1ICO0.78
DPRD-PROLINEA,B1XOF0.78
DPRD-PROLINEP1MCC0.78
DPRD-PROLINEA,B,C,D1SNA0.78
HY33-HYDROXYPROLINEA,B,G2G660.73
MLLMETHYL L-LEUCINATEC,F,M,N2IAE0.74
HYP4-HYDROXYPROLINEA1OB40.74
HYP4-HYDROXYPROLINEA,B,C1QSU0.74
HYP4-HYDROXYPROLINEA,C,E,G,I,K,
M,O
1GK80.74
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V6A0.74
HYP4-HYDROXYPROLINEE,F,G,H,I,J2F6A0.74
HYP4-HYDROXYPROLINEA1TCH0.74
HYP4-HYDROXYPROLINEA1KCP0.74
HYP4-HYDROXYPROLINEA2JTU0.74
HYP4-HYDROXYPROLINEA,B,C,I,J,L,M1K830.74
HYP4-HYDROXYPROLINEA3E2Q0.74
HYP4-HYDROXYPROLINEA1TR60.74
HYP4-HYDROXYPROLINEA1P1P0.74
HYP4-HYDROXYPROLINEB,C,E,F,H,I,
K,L,M,N,O,P,
Q,R,S,T
2HOD0.74
HYP4-HYDROXYPROLINEA,B,C,D2V530.74
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V680.74
HYP4-HYDROXYPROLINEA2VUV0.74
HYP4-HYDROXYPROLINEA1EYO0.74
HYP4-HYDROXYPROLINED,H2FES0.74
HYP4-HYDROXYPROLINEA,B,E,F3EJH0.74
HYP4-HYDROXYPROLINEA2JQB0.74
HYP4-HYDROXYPROLINEA2P4L0.74
HYP4-HYDROXYPROLINEA2H9X0.74
HYP4-HYDROXYPROLINEA1AV30.74
HYP4-HYDROXYPROLINEA1TCJ0.74
HYP4-HYDROXYPROLINEA2IHA0.74
HYP4-HYDROXYPROLINEA,B,C1BKV0.74
HYP4-HYDROXYPROLINEA1R9U0.74
HYP4-HYDROXYPROLINEA1AG70.74
HYP4-HYDROXYPROLINEA1GQ00.74
HYP4-HYDROXYPROLINEA1R9I0.74
HYP4-HYDROXYPROLINEH1LM80.74
HYP4-HYDROXYPROLINEA,B,C,E,F,H,
J,K,M,O,P,R,
T,V,W
1UZH0.74
HYP4-HYDROXYPROLINEA,B,C,D,E,F1EI80.74
HYP4-HYDROXYPROLINEA,B,C1Q7D0.74
HYP4-HYDROXYPROLINEA1VIB0.74
HYP4-HYDROXYPROLINED,H2FEQ0.74
HYP4-HYDROXYPROLINEA1DG00.74
HYP4-HYDROXYPROLINEB,C,D,F1DZI0.74
HYP4-HYDROXYPROLINEA1GIB0.74
HYP4-HYDROXYPROLINEA,D1LQB0.74
HYP4-HYDROXYPROLINEA,B,C3DMW0.74
HYP4-HYDROXYPROLINEA2JQC0.74
HYP4-HYDROXYPROLINEA,B,C,D,E,F1X1K0.74
HYP4-HYDROXYPROLINEA1IEO0.74
HYP4-HYDROXYPROLINED,H1NZQ0.74
HYP4-HYDROXYPROLINEA2JRY0.74
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V670.74
HYP4-HYDROXYPROLINEA,B1JOH0.74
HYP4-HYDROXYPROLINEA1PQR0.74
HYP4-HYDROXYPROLINEA1TTL0.74
HYP4-HYDROXYPROLINEA2B5Q0.74
HYP4-HYDROXYPROLINEA,B,C1CAG0.74
HYP4-HYDROXYPROLINEA2EW40.74
HYP4-HYDROXYPROLINEB,C,E,F,G,H2HLO0.74
HYP4-HYDROXYPROLINEA2YYF0.74
HYP4-HYDROXYPROLINEA1G1P0.74
HYP4-HYDROXYPROLINEA,B,D,E,H,K,
O,R,V
1UWA0.74
HYP4-HYDROXYPROLINEA,B,C,E,H,I,
J,K,M,O,P,R,
T,V,W
1UW90.74
HYP4-HYDROXYPROLINEA2VUZ0.74
HYP4-HYDROXYPROLINEA1QFB0.74
HYP4-HYDROXYPROLINED,H1O0D0.74
HYP4-HYDROXYPROLINEA,B,C,D,E,F2D3F0.74
HYP4-HYDROXYPROLINEA2J150.74
HYP4-HYDROXYPROLINEA1DFZ0.74
HYP4-HYDROXYPROLINEA,B1OB60.74
HYP4-HYDROXYPROLINEA,B,C,I,J,L,M3CQZ0.74
HYP4-HYDROXYPROLINE1,2,3,4,5,6,
7,8,A,B,C,D,
E,F,G,H,I,J,
K,L,M,N,O,P,
S,T,U,V,W,X,
Y,Z
1IR20.74
HYP4-HYDROXYPROLINEA1TCK0.74
HYP4-HYDROXYPROLINEA1G1Z0.74
HYP4-HYDROXYPROLINEA,B,D,E,F,G1YM80.74
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VDI0.74
HYP4-HYDROXYPROLINEA1MTQ0.74
HYP4-HYDROXYPROLINEA,B,C,E,F,H,
I,J,K,M,O,P,
R,T,V,W
1UZD0.74
HYP4-HYDROXYPROLINEA,B,C1V7H0.74
HYP4-HYDROXYPROLINEA,B,G2G660.74
HYP4-HYDROXYPROLINEA1OB70.74
HYP4-HYDROXYPROLINEA1OMC0.74
HYP4-HYDROXYPROLINEX2HCZ0.74
HYP4-HYDROXYPROLINEA1DFY0.74
HYP4-HYDROXYPROLINEA,B,C,D,E,F2D3H0.74
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VDH0.74
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V630.74
HYP4-HYDROXYPROLINEA1IH90.74
HYP4-HYDROXYPROLINEA2IH60.74
HYP4-HYDROXYPROLINEA2IH70.74
HYP4-HYDROXYPROLINEA1JLP0.74
HYP4-HYDROXYPROLINEA,C,E,F2W650.74
HYP4-HYDROXYPROLINEA1AS50.74
HYP4-HYDROXYPROLINEA,B,C1V6Q0.74
HYP4-HYDROXYPROLINEA,B,C1V4F0.74
HYP4-HYDROXYPROLINEA,B,C1Y0F0.74
HYP4-HYDROXYPROLINEA,B,C2DRX0.74
HYP4-HYDROXYPROLINEA1K640.74
HYP4-HYDROXYPROLINEA,B,C1YGV0.74
HYP4-HYDROXYPROLINEA2B5P0.74
HYP4-HYDROXYPROLINEA,B,C2DRT0.74
HYP4-HYDROXYPROLINEA2CCO0.74
HYP4-HYDROXYPROLINEA1WCT0.74
HYP4-HYDROXYPROLINEA1D7T0.74
HYP4-HYDROXYPROLINEA1JLO0.74
HYP4-HYDROXYPROLINEA,B,C1CGD0.74
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V690.74
HYP4-HYDROXYPROLINEH,P2A2X0.74
HYP4-HYDROXYPROLINEA1DLZ0.74
HYP4-HYDROXYPROLINEA,B,C,I,J,L,
M,T
2VUM0.74
HYP4-HYDROXYPROLINEA1TCG0.74
HYP4-HYDROXYPROLINEH,P2ANK0.74
HYP4-HYDROXYPROLINEA,B,C1WZB0.74
HYP4-HYDROXYPROLINEA1BDK0.74
IMLN-METHYL-ISOLEUCINEC1CWM0.72