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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02904465

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CPI6-CARBOXYPIPERIDINEA,B,C,D,F,Q1EFR0.72
CPI6-CARBOXYPIPERIDINEB1EOL0.72
CPI6-CARBOXYPIPERIDINEB1EOJ0.72
CPI6-CARBOXYPIPERIDINEA,B,C,D,E,F,
G,H,I,J,K,L
1W3M0.72
CPI6-CARBOXYPIPERIDINEA,B2ITK0.72
CPI6-CARBOXYPIPERIDINEA,B2Q5A0.72
PBE1,1-DIMETHYL-PROLINIUMA,B2B4M0.76
PBE1,1-DIMETHYL-PROLINIUMA1R9Q0.76
PBE1,1-DIMETHYL-PROLINIUMA,B1SW10.76
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D2GGH0.71
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D1XPY0.71
0AZ(4R)-4-hydroxy-L-prolineA1GQ00.78
BG55-HYDROXYAMINO-3-METHYL-PYRROLIDINE-
2-CARBOXYLIC ACID
A1TV20.73
N7P1-ACETYL-D-PROLINEA,B,C1NX80.71
DNMN-METHYL-D-NORLEUCINEA,B1S1O0.73
DNMN-METHYL-D-NORLEUCINEA,B1S4A0.73
DNMN-METHYL-D-NORLEUCINEA1R9V0.73
MLEN-METHYLLEUCINEA,D2J9A0.7
MLEN-METHYLLEUCINEC1IKF0.7
MLEN-METHYLLEUCINEA,M,N2Z6W0.7
MLEN-METHYLLEUCINEB,D,F,H,J,L,
N,P
1C5F0.7
MLEN-METHYLLEUCINED,E,F1XQ70.7
MLEN-METHYLLEUCINEC1CWA0.7
MLEN-METHYLLEUCINEC1CWF0.7
MLEN-METHYLLEUCINEB,D,F,H,J,L,
N,P,R,T
2RMB0.7
MLEN-METHYLLEUCINEB3CYS0.7
MLEN-METHYLLEUCINEC1CWH0.7
MLEN-METHYLLEUCINEA,B,C,D,E,F,
G,H
3BO70.7
MLEN-METHYLLEUCINEC1CYN0.7
MLEN-METHYLLEUCINEA1LV90.7
MLEN-METHYLLEUCINEC,D2OJU0.7
MLEN-METHYLLEUCINEB,D,F,H,J,L,
N,P,R,T
2RMA0.7
MLEN-METHYLLEUCINEA1IKM0.7
MLEN-METHYLLEUCINEC1CWK0.7
MLEN-METHYLLEUCINEA,B2HG80.7
MLEN-METHYLLEUCINEC1CWB0.7
MLEN-METHYLLEUCINEC1CWJ0.7
MLEN-METHYLLEUCINEA1CYB0.7
MLEN-METHYLLEUCINED1QNG0.7
MLEN-METHYLLEUCINEB1MIK0.7
MLEN-METHYLLEUCINEA1CSA0.7
MLEN-METHYLLEUCINEC1CWL0.7
MLEN-METHYLLEUCINEA1CYA0.7
MLEN-METHYLLEUCINEA,B,D1MF80.7
MLEN-METHYLLEUCINEC1BCK0.7
MLEN-METHYLLEUCINEA,B,D,E,F,H1M630.7
MLEN-METHYLLEUCINEC1CWC0.7
MLEN-METHYLLEUCINEC1CWI0.7
MLEN-METHYLLEUCINEC,D1QNH0.7
MLEN-METHYLLEUCINEB,D,F,H2RMC0.7
MLEN-METHYLLEUCINEC1CWM0.7
MLEN-METHYLLEUCINET,U,V2POY0.7
MLEN-METHYLLEUCINEA,B,C,D,E,F,
I,J,K,L,M,N
2ESL0.7
MLEN-METHYLLEUCINEC1CWO0.7
MLEN-METHYLLEUCINEA1IKL0.7
MMON~5~-(DIAMINOMETHYLENE)-N~2~-METHYLORNITHINEA1EB10.7
BG45-(HYDROXY-METHYL-AMINO)-3-METHYL-
PYRROLIDINE-2-CARBOXYLIC ACID
A1TV30.71
4FB(4S)-4-FLUORO-L-PROLINEA2Q6P0.93
H5MTRANS-3-HYDROXY-5-METHYLPROLINEA,B1A7Z0.7
HYP4-HYDROXYPROLINEA1OB40.78
HYP4-HYDROXYPROLINEA,B,C1QSU0.78
HYP4-HYDROXYPROLINEA,C,E,G,I,K,
M,O
1GK80.78
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V6A0.78
HYP4-HYDROXYPROLINEE,F,G,H,I,J2F6A0.78
HYP4-HYDROXYPROLINEA1TCH0.78
HYP4-HYDROXYPROLINEA1KCP0.78
HYP4-HYDROXYPROLINEA2JTU0.78
HYP4-HYDROXYPROLINEA,B,C,I,J,L,M1K830.78
HYP4-HYDROXYPROLINEA3E2Q0.78
HYP4-HYDROXYPROLINEA1TR60.78
HYP4-HYDROXYPROLINEA1P1P0.78
HYP4-HYDROXYPROLINEB,C,E,F,H,I,
K,L,M,N,O,P,
Q,R,S,T
2HOD0.78
HYP4-HYDROXYPROLINEA,B,C,D2V530.78
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V680.78
HYP4-HYDROXYPROLINEA2VUV0.78
HYP4-HYDROXYPROLINEA1EYO0.78
HYP4-HYDROXYPROLINED,H2FES0.78
HYP4-HYDROXYPROLINEA,B,E,F3EJH0.78
HYP4-HYDROXYPROLINEA2JQB0.78
HYP4-HYDROXYPROLINEA2P4L0.78
HYP4-HYDROXYPROLINEA2H9X0.78
HYP4-HYDROXYPROLINEA1AV30.78
HYP4-HYDROXYPROLINEA1TCJ0.78
HYP4-HYDROXYPROLINEA2IHA0.78
HYP4-HYDROXYPROLINEA,B,C1BKV0.78
HYP4-HYDROXYPROLINEA1R9U0.78
HYP4-HYDROXYPROLINEA1AG70.78
HYP4-HYDROXYPROLINEA1GQ00.78
HYP4-HYDROXYPROLINEA1R9I0.78
HYP4-HYDROXYPROLINEH1LM80.78
HYP4-HYDROXYPROLINEA,B,C,E,F,H,
J,K,M,O,P,R,
T,V,W
1UZH0.78
HYP4-HYDROXYPROLINEA,B,C,D,E,F1EI80.78
HYP4-HYDROXYPROLINEA,B,C1Q7D0.78
HYP4-HYDROXYPROLINEA1VIB0.78
HYP4-HYDROXYPROLINED,H2FEQ0.78
HYP4-HYDROXYPROLINEA1DG00.78
HYP4-HYDROXYPROLINEB,C,D,F1DZI0.78
HYP4-HYDROXYPROLINEA1GIB0.78
HYP4-HYDROXYPROLINEA,D1LQB0.78
HYP4-HYDROXYPROLINEA,B,C3DMW0.78
HYP4-HYDROXYPROLINEA2JQC0.78
HYP4-HYDROXYPROLINEA,B,C,D,E,F1X1K0.78
HYP4-HYDROXYPROLINEA1IEO0.78
HYP4-HYDROXYPROLINED,H1NZQ0.78
HYP4-HYDROXYPROLINEA2JRY0.78
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V670.78
HYP4-HYDROXYPROLINEA,B1JOH0.78
HYP4-HYDROXYPROLINEA1PQR0.78
HYP4-HYDROXYPROLINEA1TTL0.78
HYP4-HYDROXYPROLINEA2B5Q0.78
HYP4-HYDROXYPROLINEA,B,C1CAG0.78
HYP4-HYDROXYPROLINEA2EW40.78
HYP4-HYDROXYPROLINEB,C,E,F,G,H2HLO0.78
HYP4-HYDROXYPROLINEA2YYF0.78
HYP4-HYDROXYPROLINEA1G1P0.78
HYP4-HYDROXYPROLINEA,B,D,E,H,K,
O,R,V
1UWA0.78
HYP4-HYDROXYPROLINEA,B,C,E,H,I,
J,K,M,O,P,R,
T,V,W
1UW90.78
HYP4-HYDROXYPROLINEA2VUZ0.78
HYP4-HYDROXYPROLINEA1QFB0.78
HYP4-HYDROXYPROLINED,H1O0D0.78
HYP4-HYDROXYPROLINEA,B,C,D,E,F2D3F0.78
HYP4-HYDROXYPROLINEA2J150.78
HYP4-HYDROXYPROLINEA1DFZ0.78
HYP4-HYDROXYPROLINEA,B1OB60.78
HYP4-HYDROXYPROLINEA,B,C,I,J,L,M3CQZ0.78
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
1IR20.78
HYP4-HYDROXYPROLINEA1TCK0.78
HYP4-HYDROXYPROLINEA1G1Z0.78
HYP4-HYDROXYPROLINEA,B,D,E,F,G1YM80.78
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VDI0.78
HYP4-HYDROXYPROLINEA1MTQ0.78
HYP4-HYDROXYPROLINEA,B,C,E,F,H,
I,J,K,M,O,P,
R,T,V,W
1UZD0.78
HYP4-HYDROXYPROLINEA,B,C1V7H0.78
HYP4-HYDROXYPROLINEA,B,G2G660.78
HYP4-HYDROXYPROLINEA1OB70.78
HYP4-HYDROXYPROLINEA1OMC0.78
HYP4-HYDROXYPROLINEX2HCZ0.78
HYP4-HYDROXYPROLINEA1DFY0.78
HYP4-HYDROXYPROLINEA,B,C,D,E,F2D3H0.78
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VDH0.78
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V630.78
HYP4-HYDROXYPROLINEA1IH90.78
HYP4-HYDROXYPROLINEA2IH60.78
HYP4-HYDROXYPROLINEA2IH70.78
HYP4-HYDROXYPROLINEA1JLP0.78
HYP4-HYDROXYPROLINEA,C,E,F2W650.78
HYP4-HYDROXYPROLINEA1AS50.78
HYP4-HYDROXYPROLINEA,B,C1V6Q0.78
HYP4-HYDROXYPROLINEA,B,C1V4F0.78
HYP4-HYDROXYPROLINEA,B,C1Y0F0.78
HYP4-HYDROXYPROLINEA,B,C2DRX0.78
HYP4-HYDROXYPROLINEA1K640.78
HYP4-HYDROXYPROLINEA,B,C1YGV0.78
HYP4-HYDROXYPROLINEA2B5P0.78
HYP4-HYDROXYPROLINEA,B,C2DRT0.78
HYP4-HYDROXYPROLINEA2CCO0.78
HYP4-HYDROXYPROLINEA1WCT0.78
HYP4-HYDROXYPROLINEA1D7T0.78
HYP4-HYDROXYPROLINEA1JLO0.78
HYP4-HYDROXYPROLINEA,B,C1CGD0.78
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V690.78
HYP4-HYDROXYPROLINEH,P2A2X0.78
HYP4-HYDROXYPROLINEA1DLZ0.78
HYP4-HYDROXYPROLINEA,B,C,I,J,L,
M,T
2VUM0.78
HYP4-HYDROXYPROLINEA1TCG0.78
HYP4-HYDROXYPROLINEH,P2ANK0.78
HYP4-HYDROXYPROLINEA,B,C1WZB0.78
HYP4-HYDROXYPROLINEA1BDK0.78
HY33-HYDROXYPROLINEA,B,G2G660.77
IMLN-METHYL-ISOLEUCINEC1CWM0.7
DPL4-OXOPROLINEA,B,C1QFI0.83
ORQN~5~-ACETYL-L-ORNITHINEP,Q2FX90.71
AN0N-ACETYL-L-NORVALINEC,D,E,X,Y,Z2G7M0.72
AN0N-ACETYL-L-NORVALINEA1ZQ80.72
DPRD-PROLINEP1MCB0.89
DPRD-PROLINEA,B,C,H,K,L2R5B0.89
DPRD-PROLINEA2KDQ0.89
DPRD-PROLINEP1MCS0.89
DPRD-PROLINEA,B2AXI0.89
DPRD-PROLINEA1JY90.89
DPRD-PROLINEA2JUE0.89
DPRD-PROLINEP1MCK0.89
DPRD-PROLINEP1MCR0.89
DPRD-PROLINEA2D550.89
DPRD-PROLINEA1T8J0.89
DPRD-PROLINEA,B2EJ60.89
DPRD-PROLINEP1MCE0.89
DPRD-PROLINEP1MCI0.89
DPRD-PROLINEA,B1SNE0.89
DPRD-PROLINEA,B,C1QFI0.89
DPRD-PROLINEA,P1MCD0.89
DPRD-PROLINEA1ICL0.89
DPRD-PROLINEP1MCQ0.89
DPRD-PROLINEG,M,P,S2I5Y0.89
DPRD-PROLINEA,B,C,D3BOG0.89
DPRD-PROLINEA,L1ZEA0.89
DPRD-PROLINEA,B173D0.89
DPRD-PROLINEA,P1MCJ0.89
DPRD-PROLINEA,B,C1A7Y0.89
DPRD-PROLINEA1IC90.89
DPRD-PROLINEA,B1JY60.89
DPRD-PROLINEA209D0.89
DPRD-PROLINEA1BFW0.89
DPRD-PROLINEA,B1O6I0.89
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
1UNJ0.89
DPRD-PROLINEA,B,C,D2R3C0.89
DPRD-PROLINEA,B,C,D1I3W0.89
DPRD-PROLINEA316D0.89
DPRD-PROLINEA,B,C,D1SN90.89
DPRD-PROLINEA,B,C,H,K,L2R5D0.89
DPRD-PROLINEA,B2Q330.89
DPRD-PROLINEG,M,P,S2I600.89
DPRD-PROLINEA,B1JY40.89
DPRD-PROLINEP1MCF0.89
DPRD-PROLINEA,B,C,D,E,F1UNM0.89
DPRD-PROLINEA1ICO0.89
DPRD-PROLINEA,B1XOF0.89
DPRD-PROLINEP1MCC0.89
DPRD-PROLINEA,B,C,D1SNA0.89
AORN~2~-ACETYL-L-ORNITHINEA1ZQ60.75