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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00847193

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
1ALALLANTOATE IONA,B,D,E,F,G,H2YZC0.7
1ALALLANTOATE IONA,B1Z2L0.7
OXCOXONIC ACIDA,B2E6F0.82
OXCOXONIC ACIDA1R4U0.82
IDH(5S)-5-IODODIHYDRO-2,4(1H,3H)-PYRIMIDINEDIONEA,B,C,D1GTH0.71
NCBN-CARBAMOYL-ALANINEA,B,C,D,E,F,
G,H,I,J
1QMV0.72
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B1OEX0.7
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWX0.7
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVW0.7
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVX0.7
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWW0.7
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B1GKT0.7
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA2OWC0.7
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVV0.7
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVT0.7
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2VS20.7
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA1OEW0.7
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,I1GVU0.7
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2JJJ0.7
SUI(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACIDA,B2JJI0.7
URPN-(AMINOCARBONYL)-BETA-ALANINEA,B,C,D2V8V0.71
URPN-(AMINOCARBONYL)-BETA-ALANINEA,B,C,D2FVM0.71
URPN-(AMINOCARBONYL)-BETA-ALANINEA,B,C,D2V8H0.71
1753,5-DIHYDRO-5-METHYLIDENE-4H-IMIDAZOL-
4-ON
A,B,C,D,E,F,
G,H
1T6P0.76
1753,5-DIHYDRO-5-METHYLIDENE-4H-IMIDAZOL-
4-ON
A,B1T6J0.76
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z260.71
NCDN-CARBAMOYL-L-ASPARTATEA,B1J790.71
NCDN-CARBAMOYL-L-ASPARTATEA,B1XGE0.71
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z290.71
NCDN-CARBAMOYL-L-ASPARTATEA,B,G,H1R0C0.71
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z270.71
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z280.71
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z2A0.71
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z240.71
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z250.71
DUCDIHYDROPYRIMIDINE-2,4(1H,3H)-DIONEA,B,C,D2FVK0.75
DUCDIHYDROPYRIMIDINE-2,4(1H,3H)-DIONEA,B1UAQ0.75
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2E680.8
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B1XGE0.8
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z290.8
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z260.8
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z270.8
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z280.8
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z2A0.8
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z240.8
DOR(4S)-2,6-DIOXOHEXAHYDROPYRIMIDINE-
4-CARBOXYLIC ACID
A,B2Z250.8