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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00018430

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AACACETYLAMINO-ACETIC ACIDA,B1NG30.82
AACACETYLAMINO-ACETIC ACIDA1QD80.82
GPJGLYPHOSATEA,B,C,D1RF60.78
GPJGLYPHOSATEA1G6S0.78
GPJGLYPHOSATEA2AAY0.78
GPJGLYPHOSATEA2GGA0.78
GPJGLYPHOSATEA2QFT0.78
GPJGLYPHOSATEA2QFU0.78
GPJGLYPHOSATEA2GGD0.78
OGAN-OXALYOLGLYCINEA,B,C,D2OQ60.76
OGAN-OXALYOLGLYCINEA2RDS0.76
OGAN-OXALYOLGLYCINEA1H2M0.76
OGAN-OXALYOLGLYCINEA2QRL0.76
OGAN-OXALYOLGLYCINEA,B,C,D2OX00.76
OGAN-OXALYOLGLYCINEA2RDR0.76
OGAN-OXALYOLGLYCINEA,B,C,D2OS20.76
OGAN-OXALYOLGLYCINEA,B,I,J2PXJ0.76
OGAN-OXALYOLGLYCINEA,B,F,G2Q8E0.76
OGAN-OXALYOLGLYCINEA,B,I,J2P5B0.76
OGAN-OXALYOLGLYCINEA1H2K0.76
OGAN-OXALYOLGLYCINEA,B,C,D2OT70.76
OGAN-OXALYOLGLYCINEA,B2OQ70.76
NXAN-CARBOXYALANINEA2IUX0.73
NXAN-CARBOXYALANINEA1O8A0.73
IPGN-ISOPROPYL GLYCINEC,D2SEM0.82
SARSARCOSINEA,B173D1
SARSARCOSINEA,B1FJA1
SARSARCOSINEB3CYS1
SARSARCOSINEA,B,C1A7Y1
SARSARCOSINEA,B,C,D1I3W1
SARSARCOSINEA316D1
SARSARCOSINEC1IKF1
SARSARCOSINEA,M,N2Z6W1
SARSARCOSINEA,B,C1QFI1
SARSARCOSINEC1CWA1
SARSARCOSINEC1CWF1
SARSARCOSINEB,D,F,H,J,L,
N,P
1C5F1
SARSARCOSINEC1CWO1
SARSARCOSINED,E,F1XQ71
SARSARCOSINEC1CWL1
SARSARCOSINEA1CYA1
SARSARCOSINEA,B,D1MF81
SARSARCOSINEA,B1A7Z1
SARSARCOSINEB1MIK1
SARSARCOSINEA1CSA1
SARSARCOSINEC1CWM1
SARSARCOSINEA1DSC1
SARSARCOSINET,U,V2POY1
SARSARCOSINEA2D551
SARSARCOSINEC1BCK1
SARSARCOSINEA,B,D,E,F,H1M631
SARSARCOSINEC1CWC1
SARSARCOSINEC,D1QNH1
SARSARCOSINEB,D,F,H2RMC1
SARSARCOSINEC1CYN1
SARSARCOSINEC,D1MNV1
SARSARCOSINEC,D2OJU1
SARSARCOSINEB,D,F,H,J,L,
N,P,R,T
2RMA1
SARSARCOSINEA1CYB1
SARSARCOSINED1QNG1
SARSARCOSINEC1CWB1
SARSARCOSINEA,B,C,D,E,F1UNM1
SARSARCOSINEA,B1OVF1
SARSARCOSINEA209D1
SARSARCOSINEA,B,C,D,E,F,
G,H
3BO71
SARSARCOSINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V,W,X
1UNJ1
SARSARCOSINEA1DSD1
SARSARCOSINEB1L1V1
SARSARCOSINEA,B,C,D,E,F,
I,J,K,L,M,N
2ESL1
SARSARCOSINEB,D,F,H,J,L,
N,P,R,T
2RMB1
MSA(2-S-METHYL) SARCOSINEC1CWK0.76
MSA(2-S-METHYL) SARCOSINEC1CWJ0.76
CMSCARBAMOYL SARCOSINEA,B1CHM0.71
CL5N-(3-OXOPROPYL)GLYCINEA2IOT0.7
MAAN-METHYLALANINEA,B1A7Z0.8
MAAN-METHYLALANINEA,B2VSL0.8
MAAN-METHYLALANINEC1CWI0.8
MAAN-METHYLALANINEC,F,G,H3DW80.8
MAAN-METHYLALANINEA,B,C,D,E,F,
G,H
2NYL0.8
MAAN-METHYLALANINED1D5X0.8
MAAN-METHYLALANINEC1PYW0.8
MAAN-METHYLALANINEA,B,C,D,E,F,
G,H
2NYM0.8
MAAN-METHYLALANINEC,I2IE30.8
MAAN-METHYLALANINEC,F,X,Y2NPP0.8
LALN,N-DIMETHYL-L-ALANINEA,B1R1G0.7
IOM(DIAMINOMETHYL-METHYL-AMINO)-ACETIC ACIDA,B1U6R0.79
IOM(DIAMINOMETHYL-METHYL-AMINO)-ACETIC ACIDA1RL90.79
IOM(DIAMINOMETHYL-METHYL-AMINO)-ACETIC ACIDA,B1VRP0.79
DALD-ALANINET,U,V2POY0.71
DALD-ALANINEC1CWI0.71
DALD-ALANINEC,D1QNH0.71
DALD-ALANINEA1CYA0.71
DALD-ALANINEI1HBT0.71
DALD-ALANINEA,B1XOF0.71
DALD-ALANINEA1XT70.71
DALD-ALANINEA2DDE0.71
DALD-ALANINEA,B2Q330.71
DALD-ALANINEA,B,C,D1ZMI0.71
DALD-ALANINEA,B,C,D1SN90.71
DALD-ALANINEA,B,C,D2R3C0.71
DALD-ALANINEC,F,M,N2IAE0.71
DALD-ALANINEA1W9N0.71
DALD-ALANINEC,F,X,Y2NPP0.71
DALD-ALANINEE,S148L0.71
DALD-ALANINEA,B,C,D,E,F1FVM0.71
DALD-ALANINEC1IKF0.71
DALD-ALANINEA1T5N0.71
DALD-ALANINEA,B,C,D1ZMH0.71
DALD-ALANINEC1CWM0.71
DALD-ALANINEC1CWC0.71
DALD-ALANINEA1EVB0.71
DALD-ALANINEB,D,F,H2RMC0.71
DALD-ALANINEA,B,C2YZM0.71
DALD-ALANINEA,B,D,E,F,H1M630.71
DALD-ALANINEC1CWL0.71
DALD-ALANINEB1BZV0.71
DALD-ALANINEA1CSA0.71
DALD-ALANINEA,B,N,P1HHY0.71
DALD-ALANINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,S
1GO60.71
DALD-ALANINEB1MIK0.71
DALD-ALANINED1QNG0.71
DALD-ALANINEA1CYB0.71
DALD-ALANINEA,B,C,D2ZDH0.71
DALD-ALANINEC1CWB0.71
DALD-ALANINEL,N1WCO0.71
DALD-ALANINEC1CWK0.71
DALD-ALANINEA,B,C,H,K,L2R5B0.71
DALD-ALANINEC1CYN0.71
DALD-ALANINEA1QTE0.71
DALD-ALANINEC,F,G,H3DW80.71
DALD-ALANINEA,B2GYP0.71
DALD-ALANINEA,B,C,D,E,F,
G,H
2NYL0.71
DALD-ALANINEA,B,C,D,E,F,
G,H
3BO70.71
DALD-ALANINED1PEK0.71
DALD-ALANINEA,B2J9P0.71
DALD-ALANINEA3DHV0.71
DALD-ALANINEA,B,C,H,K,L2R5D0.71
DALD-ALANINEC1CWH0.71
DALD-ALANINEA1C4B0.71
DALD-ALANINEA,B,C,D3BOG0.71
DALD-ALANINEC2IH10.71
DALD-ALANINEA1T5M0.71
DALD-ALANINEA,B2ZDQ0.71
DALD-ALANINEA1IC90.71
DALD-ALANINEB1VBS0.71
DALD-ALANINEB,D,F,H,J,L,
N,P,R,T
2RMB0.71
DALD-ALANINEA1ICL0.71
DALD-ALANINEA,D2Q3I0.71
DALD-ALANINEC,I2IE30.71
DALD-ALANINEA,B1ZMK0.71
DALD-ALANINEB2K9R0.71
DALD-ALANINEA,B,M,N1FJM0.71
DALD-ALANINEA,B1SNE0.71
DALD-ALANINEB,C3BV90.71
DALD-ALANINEA2HVF0.71
DALD-ALANINEL2EAX0.71
DALD-ALANINEA,B,C,D,E,F,
I,J,K,L,M,N
2ESL0.71
DALD-ALANINEA,B,C,D,E,M1HHU0.71
DALD-ALANINEA,B,C,D1SNA0.71
DALD-ALANINEC1BCK0.71
DALD-ALANINEA1IKI0.71
DALD-ALANINEA,B,D1MF80.71
DALD-ALANINEA,B,C,D2APH0.71
DALD-ALANINEC1CWJ0.71
DALD-ALANINEA1ICO0.71
DALD-ALANINEC,D2OJU0.71
DALD-ALANINEB,D,F,H,J,L,
N,P,R,T
2RMA0.71
DALD-ALANINEA1C0P0.71
DALD-ALANINEA1BFW0.71
DALD-ALANINEA1AJ10.71
DALD-ALANINEA1KTO0.71
DALD-ALANINEA,D1CZQ0.71
DALD-ALANINEB3CYS0.71
DALD-ALANINEC1CWA0.71
DALD-ALANINEC1CWF0.71
DALD-ALANINEA,B1P4N0.71
DALD-ALANINED,E,F1XQ70.71
DALD-ALANINEB,D,F,H,J,L,
N,P
1C5F0.71
DALD-ALANINEC2IH30.71
DALD-ALANINEA,M,N2Z6W0.71
DALD-ALANINEA1EVA0.71
DALD-ALANINEA1LCM0.71
DALD-ALANINEU2AIZ0.71
DALD-ALANINEA,B,C,D,E,F,
G,H
2NYM0.71
GPFN-(phosphonomethyl)glycineA3FJZ0.78
GPFN-(phosphonomethyl)glycineA3FK10.78
BETTRIMETHYL GLYCINEA1RCC0.8
BETTRIMETHYL GLYCINEA,B3DSB0.8
BETTRIMETHYL GLYCINEA1RCI0.8
BETTRIMETHYL GLYCINEA1SW20.8
BETTRIMETHYL GLYCINEA1RCE0.8
BETTRIMETHYL GLYCINEA1R9L0.8
BETTRIMETHYL GLYCINEA1RCD0.8
BETTRIMETHYL GLYCINEA,B,C2WIT0.8
BETTRIMETHYL GLYCINEA2B4L0.8
BETTRIMETHYL GLYCINEA1RCG0.8
BETTRIMETHYL GLYCINEA,B,C,D1WWJ0.8
DMGN,N-DIMETHYLGLYCINEA,B,C,D1VRQ0.8
DMGN,N-DIMETHYLGLYCINEA,B,C,D1X310.8
DMGN,N-DIMETHYLGLYCINEA,B,C1XKP0.8
DMGN,N-DIMETHYLGLYCINEA,B1EL50.8
NTANITRILOTRIACETIC ACIDA1GVC0.73
NTANITRILOTRIACETIC ACIDA1NFT0.73
AYAN-ACETYLALANINEA1D0W0.71
AYAN-ACETYLALANINEA1AH40.71
AYAN-ACETYLALANINEA,B1VBP0.71
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1J4T0.71
AYAN-ACETYLALANINEA,B,C,D1OUW0.71
AYAN-ACETYLALANINEA1AH30.71
AYAN-ACETYLALANINEA1EKO0.71
AYAN-ACETYLALANINEB,D,F,H2V4I0.71
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1VBO0.71
AYAN-ACETYLALANINEA,B,C,D1J4U0.71
NMCN-CYCLOPROPYLMETHYL GLYCINEC,D3SEM0.72
NMGGUANIDINO ACETATEA1XCJ0.76