Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02325912
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
---|---|---|---|---|---|
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
EOD | 11-[(2R,3S)-3-PENTYLOXIRAN-2-YL]UNDECANOIC ACID | A,B,C | 2DIO | 0.75 | |
BFC | (R)-3-HYDROXYTETRADECANAL | A | 2NPV | 0.74 | |
B3H | (2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATE | C,D | 2HFE | 0.77 | |
B3H | (2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATE | C,D | 2H8P | 0.77 | |
B3H | (2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATE | C,D | 2HG5 | 0.77 | |
LNG | 12-METHYLTRIDECANOIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1W3M | 0.79 | |
E4H | (3R,4S,5S,7R,9E,11R,12R)-12-ETHYL- 4-HYDROXY-3,5,7,11-TETRAMETHYLOXACYCLODODEC- 9-ENE-2,8-DIONE | A,B | 2HFK | 0.71 | |
PAY | OCTANE-1,3,5,7-TETRACARBOXYLIC ACID | A,B | 2V77 | 0.74 | |
12H | 12-HYDROXYDODECANOIC ACID | A,B | 1M6W | 0.73 | |
1EM | (1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATE | C | 2IH1 | 0.76 | |
1EM | (1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATE | C | 2IH3 | 0.76 | |
1EM | (1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATE | A,C | 2P7T | 0.76 | |
DDR | (2S)-3-hydroxypropane-1,2-diyl didecanoate | A | 2Z9Y | 0.76 | |
DDR | (2S)-3-hydroxypropane-1,2-diyl didecanoate | A | 2Z9Z | 0.76 | |
OOA | 3-OXOOCTANOIC ACID | A,B,C,D | 1H0M | 0.7 | |
LIL | 2-TRIDECANOYLOXY-PENTADECANOIC ACID | A | 2FCP | 0.82 | |
LIL | 2-TRIDECANOYLOXY-PENTADECANOIC ACID | A | 1FCP | 0.82 | |
TWN | (3S)-3-[(2S,3S,4R)-3,4-DIMETHYLTETRAHYDROFURAN- 2-YL]BUTYL LAURATE | A,B | 2IVD | 0.76 | |
TWN | (3S)-3-[(2S,3S,4R)-3,4-DIMETHYLTETRAHYDROFURAN- 2-YL]BUTYL LAURATE | A,B | 2IVE | 0.76 | |
HXD | (3R)-3-HYDROXYDODECANOIC ACID | A | 2DDH | 0.85 | |
FTT | 3-HYDROXY-TETRADECANOIC ACID | A | 1QFF | 0.85 | |
FTT | 3-HYDROXY-TETRADECANOIC ACID | A | 1QJQ | 0.85 | |
FTT | 3-HYDROXY-TETRADECANOIC ACID | A,B | 2GRX | 0.85 | |
FTT | 3-HYDROXY-TETRADECANOIC ACID | A | 1QFG | 0.85 | |
FTT | 3-HYDROXY-TETRADECANOIC ACID | A | 1QKC | 0.85 | |
FTT | 3-HYDROXY-TETRADECANOIC ACID | A | 1FI1 | 0.85 | |
FTT | 3-HYDROXY-TETRADECANOIC ACID | A,B,C,D | 3FXI | 0.85 | |
DGA | DIACYL GLYCEROL | A,C | 2NLJ | 0.75 | |
DGA | DIACYL GLYCEROL | A,C | 1ZWI | 0.75 | |
DGA | DIACYL GLYCEROL | B,C | 1R3J | 0.75 | |
DGA | DIACYL GLYCEROL | C | 1K4D | 0.75 | |
DGA | DIACYL GLYCEROL | A,C | 1K4C | 0.75 | |
DGA | DIACYL GLYCEROL | C | 1R3K | 0.75 | |
DGA | DIACYL GLYCEROL | B,C | 1S5H | 0.75 | |
DGA | DIACYL GLYCEROL | C,H | 1R3I | 0.75 | |
DGA | DIACYL GLYCEROL | B,C | 1R3L | 0.75 | |
DGG | 1-[GLYCEROLYLPHOSPHONYL]-2-[8-(2- HEXYL-CYCLOPROPYL)-OCTANAL-1-YL]- 3-[HEXADECANAL-1-YL]-GLYCEROL | A,B | 1CQX | 0.74 | |
L2C | (2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATE | A,C | 2HVK | 0.76 | |
L2C | (2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATE | A,C | 2DWD | 0.76 | |
L2C | (2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATE | C | 2DWE | 0.76 | |
L2C | (2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATE | A,C | 2HVJ | 0.76 | |
CXP | CYCLOHEXANE PROPIONIC ACID | A,B | 2AY2 | 0.74 | |
3PA | 3-CYCLOPENTYL-PROPIONIC ACID | C | 1FAV | 0.72 | |
DEB | 6-DEOXYERYTHRONOLIDE B | A | 1Z8P | 0.85 | |
DEB | 6-DEOXYERYTHRONOLIDE B | A | 1JIO | 0.85 | |
DEB | 6-DEOXYERYTHRONOLIDE B | A | 1Z8Q | 0.85 | |
DEB | 6-DEOXYERYTHRONOLIDE B | A | 1OXA | 0.85 | |
DEB | 6-DEOXYERYTHRONOLIDE B | A | 1Z8O | 0.85 | |
F24 | (3R,5S,7R,12S,13R)-13-FORMYL-12,14- DIHYDROXY-3,5,7-TRIMETHYLTETRADECANOIC ACID | A | 2F9A | 0.86 | |
LIM | 3-OXO-PENTADECANOIC ACID | A | 2FCP | 0.72 | |
LIM | 3-OXO-PENTADECANOIC ACID | A | 1UJW | 0.72 | |
LIM | 3-OXO-PENTADECANOIC ACID | A | 1FCP | 0.72 | |
GVM | (3R)-3-HYDROXY-5,5-DIMETHYLHEXANOIC ACID | A,B | 2UW1 | 0.78 | |
HOC | (2S)-2-HYDROXYOCTANOIC ACID | A | 2A85 | 0.73 | |
STA | STATINE | E | 1EPP | 0.72 | |
STA | STATINE | I | 1XN3 | 0.72 | |
STA | STATINE | A,B,I,J | 2FIV | 0.72 | |
STA | STATINE | A,B,C,D | 1QS8 | 0.72 | |
STA | STATINE | A,B | 2RMP | 0.72 | |
STA | STATINE | E,I | 1APU | 0.72 | |
STA | STATINE | A,I | 1GVU | 0.72 | |
STA | STATINE | I | 3ER5 | 0.72 | |
STA | STATINE | I | 2ER9 | 0.72 | |
STA | STATINE | E,I | 4ER2 | 0.72 | |
STA | STATINE | A,C,I,J,K | 2B7F | 0.72 | |
STA | STATINE | A,B,C | 5HVP | 0.72 | |
STA | STATINE | A,I | 1GVV | 0.72 | |
STA | STATINE | A,I | 1WKR | 0.72 | |
STA | STATINE | I | 5APR | 0.72 | |
STA | STATINE | I | 1PSO | 0.72 | |
STA | STATINE | I | 6APR | 0.72 | |
STA | STATINE | A | 1FQ5 | 0.72 | |
STA | STATINE | A,I | 3FNT | 0.72 | |
STA | STATINE | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 3FV3 | 0.72 | |
STA | STATINE | A,B,C,D,I,J | 1LYB | 0.72 | |
STA | STATINE | B | 1FIV | 0.72 | |
STA | STATINE | I | 4APR | 0.72 | |
CHS | 4-AMINO-5-CYCLOHEXYL-3-HYDROXY- PENTANOIC ACID | I | 1E80 | 0.7 | |
CHS | 4-AMINO-5-CYCLOHEXYL-3-HYDROXY- PENTANOIC ACID | I | 1EED | 0.7 | |
CHS | 4-AMINO-5-CYCLOHEXYL-3-HYDROXY- PENTANOIC ACID | I | 2ER0 | 0.7 | |
YML | [(3R,4S,5S,7R)-4,8-DIHYDROXY-3,5,7- TRIMETHYL-2-OXOOCTYL]PHOSPHONIC ACID | A,B | 2HFJ | 0.73 |