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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02276108

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DLED-LEUCINEA,B1ALZ0.78
DLED-LEUCINEA,B1BDW0.78
DLED-LEUCINEA,D1CZQ0.78
DLED-LEUCINEA1BFW0.78
DLED-LEUCINEE,F,G,H1XN20.78
DLED-LEUCINEA,B,C,D1GMK0.78
DLED-LEUCINEA,B1TKQ0.78
DLED-LEUCINEA,B,C,H,K,L2R5D0.78
DLED-LEUCINEA2NPV0.78
DLED-LEUCINEA,B,C,D2R3C0.78
DLED-LEUCINEB,D,E1AFQ0.78
DLED-LEUCINEA,B1MIC0.78
DLED-LEUCINEA,B1NRU0.78
DLED-LEUCINEA,B1JNO0.78
DLED-LEUCINEA,B1GRM0.78
DLED-LEUCINEA,B1NRM0.78
DLED-LEUCINEA,D2Q3I0.78
DLED-LEUCINEA,B1NT50.78
DLED-LEUCINEA2JUE0.78
DLED-LEUCINEA,B,C,D1AV20.78
DLED-LEUCINEA1YY20.78
DLED-LEUCINEA,B1AL40.78
DLED-LEUCINEA,B1NG80.78
DLED-LEUCINEA,B1ALX0.78
DLED-LEUCINEA,B1JO40.78
DLED-LEUCINEA,B,C,H,K,L2R5B0.78
DLED-LEUCINEA,B1MAG0.78
DLED-LEUCINEA,B1NT60.78
DLED-LEUCINEA,B2Q330.78
DLED-LEUCINEA,B1JO30.78
DLED-LEUCINEE,I1BLL0.78
DLED-LEUCINEA,B1KQE0.78
DLED-LEUCINEA,B,C,D1W5U0.78
DLED-LEUCINEA,B,C,D2IZQ0.78
DLED-LEUCINEA1C4B0.78
DLED-LEUCINEA,B,C,D1C4D0.78
2CG(1R,2R)-3-[(S)-amino(carboxy)methyl]cyclopropane-
1,2-dicarboxylic acid
A,B2E4V0.72
LED(4R)-5-OXO-L-LEUCINEA2IUW0.78
BIU5-bromo-L-isoleucineA3EDS0.71
BIX(2S)-2-{[(S)-[(3S)-3-amino-3-carboxypropyl](hydroxy)phosphoryl]methyl}pentanedioic acidA3BI00.7
ILX4,5-DIHYDROXYISOLEUCINEA,B,C,I,J,L,M3CQZ0.72
ILX4,5-DIHYDROXYISOLEUCINEA,B,C,I,J,L,M1K830.72
ILX4,5-DIHYDROXYISOLEUCINEA,B,C,I,J,L,
M,T
2VUM0.72
LEF(4S)-5-FLUORO-L-LEUCINEA1OGW0.75
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
GAMALPHA-METHYL-L-GLUTAMIC ACIDA,B1BJO0.78
AA42-AMINO-5-HYDROXYPENTANOIC ACIDB1MIK0.7
AA42-AMINO-5-HYDROXYPENTANOIC ACIDE,I1QR30.7
LEPN-phosphono-L-leucineE2TMN0.72
DILD-ISOLEUCINEA,B2Q330.78
DILD-ISOLEUCINEA1CWZ0.78
DILD-ISOLEUCINEA1CVQ0.78
DILD-ISOLEUCINEA1C4B0.78
DILD-ISOLEUCINEA1CW80.78
DILD-ISOLEUCINEA2AP80.78
IILISO-ISOLEUCINEA,B,C,D1Q4V0.78
IILISO-ISOLEUCINEA1KMF0.78
IILISO-ISOLEUCINEA,B,C1TGG0.78
IILISO-ISOLEUCINEA1RH40.78
MEG(2S,3R)-3-METHYL-GLUTAMIC ACIDA1T5N0.89
MEG(2S,3R)-3-METHYL-GLUTAMIC ACIDA1T5M0.89
IKT3-(1-AMINOETHYL)NONANEDIOIC ACIDA1DAE0.7
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1Q8H0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1WV70.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L2EC90.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA,H,L,U2C4F0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA2DPQ0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDL1PFX0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1Z6J0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1AG70.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDC,H,L,T2FIR0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1ONU0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L2ZZU0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1W2K0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1WTG0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA,B,C1TGG0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,I,L,T2B8O0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1NL10.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1WQV0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA2PF20.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1WHE0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1WUN0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L,T2AER0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1ONT0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1WCT0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA,B,G1IOD0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1W0Y0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1AWY0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDC,H,L1DAN0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA,B,C1VZM0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L2AEI0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDG,L1NL00.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1AD70.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L2ZP00.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1Q3M0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA,B,C1J350.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1P0S0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1WHF0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L2ZWL0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1CFI0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA2O6N0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1MTQ0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L,T2A2Q0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA,B,C1J340.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDH,L1WSS0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA,B,C,D1LQV0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1MGX0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA,B2DPR0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA2SPT0.81
CGUGAMMA-CARBOXY-GLUTAMIC ACIDA1NL20.81
IMLN-METHYL-ISOLEUCINEC1CWM0.7
DGLD-GLUTAMIC ACIDA,B2JFX0.8
DGLD-GLUTAMIC ACIDA,B,C,H,K,L2R5D0.8
DGLD-GLUTAMIC ACIDA1C4B0.8
DGLD-GLUTAMIC ACIDA1CW80.8
DGLD-GLUTAMIC ACIDA,D1CZQ0.8
DGLD-GLUTAMIC ACIDA,B2JFY0.8
DGLD-GLUTAMIC ACIDI1QUR0.8
DGLD-GLUTAMIC ACIDA,D2Q3I0.8
DGLD-GLUTAMIC ACIDA1CVQ0.8
DGLD-GLUTAMIC ACIDA,B1P4N0.8
DGLD-GLUTAMIC ACIDA,B2VVT0.8
DGLD-GLUTAMIC ACIDE,S148L0.8
DGLD-GLUTAMIC ACIDA1KR60.8
DGLD-GLUTAMIC ACIDA,B,C,D2GZM0.8
DGLD-GLUTAMIC ACIDA1AY30.8
DGLD-GLUTAMIC ACIDA2J8F0.8
DGLD-GLUTAMIC ACIDU2AIZ0.8
DGLD-GLUTAMIC ACIDA,B,C2DWU0.8
DGLD-GLUTAMIC ACIDL2EAX0.8
DGLD-GLUTAMIC ACIDA,B2JFZ0.8
DGLD-GLUTAMIC ACIDH,I4THN0.8
DGLD-GLUTAMIC ACIDA1CWZ0.8
DGLD-GLUTAMIC ACIDP1MCK0.8
DGLD-GLUTAMIC ACIDA2JUE0.8
DGLD-GLUTAMIC ACIDA,B2JFO0.8
DGLD-GLUTAMIC ACIDA3H410.8
DGLD-GLUTAMIC ACIDA1D0K0.8
DGLD-GLUTAMIC ACIDL,N1WCO0.8
DGLD-GLUTAMIC ACIDA,B,C1ZUW0.8
DGLD-GLUTAMIC ACIDH,I5GDS0.8
DGLD-GLUTAMIC ACIDA,B,C,H,K,L2R5B0.8
DGLD-GLUTAMIC ACIDA,B2JFQ0.8
DGLD-GLUTAMIC ACIDA,B2Q330.8
DGLD-GLUTAMIC ACIDA,B2JFP0.8
DGLD-GLUTAMIC ACIDA,B,E,F2W4I0.8
DGLD-GLUTAMIC ACIDA2J8G0.8
DGLD-GLUTAMIC ACIDA,B,C,D2R3C0.8
GAU(4S)-4-AMINO-5-HYDROXYPENTANOIC ACIDA,B,C,D2CV10.7
GAU(4S)-4-AMINO-5-HYDROXYPENTANOIC ACIDA,B,C,D2DXI0.7
LME(3R)-3-METHYL-L-GLUTAMIC ACIDA1XT70.89