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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03102367

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CMSCARBAMOYL SARCOSINEA,B1CHM0.7
ACHACETYLCHOLINEA,B2RIN0.74
ACHACETYLCHOLINEA,B2HA40.74
ACHACETYLCHOLINEA2ACE0.74
ACHACETYLCHOLINEA,B,C,D,E,F2J0H0.74
EDT{[-(BIS-CARBOXYMETHYL-AMINO)-ETHYL]-
CARBOXYMETHYL-AMINO}-ACETIC ACID
A2AXN0.74
EDT{[-(BIS-CARBOXYMETHYL-AMINO)-ETHYL]-
CARBOXYMETHYL-AMINO}-ACETIC ACID
A1NNF0.74
EDT{[-(BIS-CARBOXYMETHYL-AMINO)-ETHYL]-
CARBOXYMETHYL-AMINO}-ACETIC ACID
A,B1ZLQ0.74
SARSARCOSINEA,B173D0.72
SARSARCOSINEA,B1FJA0.72
SARSARCOSINEB3CYS0.72
SARSARCOSINEA,B,C1A7Y0.72
SARSARCOSINEA,B,C,D1I3W0.72
SARSARCOSINEA316D0.72
SARSARCOSINEC1IKF0.72
SARSARCOSINEA,M,N2Z6W0.72
SARSARCOSINEA,B,C1QFI0.72
SARSARCOSINEC1CWA0.72
SARSARCOSINEC1CWF0.72
SARSARCOSINEB,D,F,H,J,L,
N,P
1C5F0.72
SARSARCOSINEC1CWO0.72
SARSARCOSINED,E,F1XQ70.72
SARSARCOSINEC1CWL0.72
SARSARCOSINEA1CYA0.72
SARSARCOSINEA,B,D1MF80.72
SARSARCOSINEA,B1A7Z0.72
SARSARCOSINEB1MIK0.72
SARSARCOSINEA1CSA0.72
SARSARCOSINEC1CWM0.72
SARSARCOSINEA1DSC0.72
SARSARCOSINET,U,V2POY0.72
SARSARCOSINEA2D550.72
SARSARCOSINEC1BCK0.72
SARSARCOSINEA,B,D,E,F,H1M630.72
SARSARCOSINEC1CWC0.72
SARSARCOSINEC,D1QNH0.72
SARSARCOSINEB,D,F,H2RMC0.72
SARSARCOSINEC1CYN0.72
SARSARCOSINEC,D1MNV0.72
SARSARCOSINEC,D2OJU0.72
SARSARCOSINEB,D,F,H,J,L,
N,P,R,T
2RMA0.72
SARSARCOSINEA1CYB0.72
SARSARCOSINED1QNG0.72
SARSARCOSINEC1CWB0.72
SARSARCOSINEA,B,C,D,E,F1UNM0.72
SARSARCOSINEA,B1OVF0.72
SARSARCOSINEA209D0.72
SARSARCOSINEA,B,C,D,E,F,
G,H
3BO70.72
SARSARCOSINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V,W,X
1UNJ0.72
SARSARCOSINEA1DSD0.72
SARSARCOSINEB1L1V0.72
SARSARCOSINEA,B,C,D,E,F,
I,J,K,L,M,N
2ESL0.72
SARSARCOSINEB,D,F,H,J,L,
N,P,R,T
2RMB0.72
DMGN,N-DIMETHYLGLYCINEA,B,C,D1VRQ0.89
DMGN,N-DIMETHYLGLYCINEA,B,C,D1X310.89
DMGN,N-DIMETHYLGLYCINEA,B,C1XKP0.89
DMGN,N-DIMETHYLGLYCINEA,B1EL50.89
BETTRIMETHYL GLYCINEA1RCC0.89
BETTRIMETHYL GLYCINEA,B3DSB0.89
BETTRIMETHYL GLYCINEA1RCI0.89
BETTRIMETHYL GLYCINEA1SW20.89
BETTRIMETHYL GLYCINEA1RCE0.89
BETTRIMETHYL GLYCINEA1R9L0.89
BETTRIMETHYL GLYCINEA1RCD0.89
BETTRIMETHYL GLYCINEA,B,C2WIT0.89
BETTRIMETHYL GLYCINEA2B4L0.89
BETTRIMETHYL GLYCINEA1RCG0.89
BETTRIMETHYL GLYCINEA,B,C,D1WWJ0.89
IOM(DIAMINOMETHYL-METHYL-AMINO)-ACETIC ACIDA,B1U6R0.74
IOM(DIAMINOMETHYL-METHYL-AMINO)-ACETIC ACIDA1RL90.74
IOM(DIAMINOMETHYL-METHYL-AMINO)-ACETIC ACIDA,B1VRP0.74
2112,2',2''-NITRILOTRIETHANOLX3H7C0.77
2112,2',2''-NITRILOTRIETHANOLA,B2HMP0.77
CHTCHOLINE IONA,B2REG0.74
CHTCHOLINE IONA,B1HCX0.74
CHTCHOLINE IONA2FY30.74
CHTCHOLINE IONA,B1H8G0.74
CHTCHOLINE IONC2VYU0.74
CHTCHOLINE IONA,B,C,D,E,F1GVM0.74
CHTCHOLINE IONA1P0M0.74
CHTCHOLINE IONA2V040.74
CHTCHOLINE IONA1OBA0.74
CHTCHOLINE IONA,B2HA30.74
CHTCHOLINE IONA,B,C,D3C5I0.74
CHTCHOLINE IONA2V050.74
BCNBICINEA,B,C,D2V8H0.94
BCNBICINEA1QUS0.94
BCNBICINEA1LTM0.94
BCNBICINEA2JC50.94
BCNBICINEA,B,C,D1V0J0.94
BCNBICINEA1QDR0.94
BCNBICINEA1KI00.94
BCNBICINEY,Z1KMI0.94
BCNBICINEA,B,C2OV50.94
BCNBICINEA2A810.94
BCNBICINEA,B,C,D2V8G0.94
BCNBICINEA,B3HWR0.94
BCNBICINEA2R6S0.94
BCNBICINEA,B2R4J0.94
DO310-((2R)-2-HYDROXYPROPYL)-1,4,7,10-
TETRAAZACYCLODODECANE 1,4,7-TRIACETIC ACID
A1H870.73
DO310-((2R)-2-HYDROXYPROPYL)-1,4,7,10-
TETRAAZACYCLODODECANE 1,4,7-TRIACETIC ACID
A,B,C,D,E,F,
G,H
2QMI0.73
IPGN-ISOPROPYL GLYCINEC,D2SEM0.72
LALN,N-DIMETHYL-L-ALANINEA,B1R1G0.78
NTANITRILOTRIACETIC ACIDA1GVC0.86
NTANITRILOTRIACETIC ACIDA1NFT0.86
MHA(CARBAMOYLMETHYL-CARBOXYMETHYL-
AMINO)-ACETIC ACID
A,B2IXX0.7
MHA(CARBAMOYLMETHYL-CARBOXYMETHYL-
AMINO)-ACETIC ACID
A,B1IX10.7