Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03421252
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 |
DEM | DECYLOXY-METHANOL | A | 1EK8 | 0.83 |  |
GVT | 3,6,9,12,15,18,21,24,27-nonaoxaheptatriacontan- 1-ol | A,B,C,D,E,F, G,H,I | 2VQG | 0.79 | |
HE4 | HEPTAN-1-OL | A | 1ZNG | 0.84 | |
CXE | PENTAETHYLENE GLYCOL MONODECYL ETHER | A,B | 2ERV | 0.81 | |
| CXE | PENTAETHYLENE GLYCOL MONODECYL ETHER | X | 1UYN | 0.81 | |
| CXE | PENTAETHYLENE GLYCOL MONODECYL ETHER | A | 1P4T | 0.81 | |
| CXE | PENTAETHYLENE GLYCOL MONODECYL ETHER | X | 1UYO | 0.81 | |
| CXE | PENTAETHYLENE GLYCOL MONODECYL ETHER | A,B | 3FID | 0.81 | |
MHN | 6-METHYLHEPTAN-1-OL | A,B | 1OYF | 0.75 | |
ODI | OCTANE-1,8-DIOL | A | 2DM5 | 0.9 | |
PQE | 3,6,12,15,18,21,24-HEPTAOXAHEXATRIACONTAN- 1-OL | A | 2NR9 | 0.75 | |
HE2 | HEXAN-1-OL | A | 1ZNE | 0.74 | |
PL3 | HEXADECAN-1-OL | A,B,C,D | 2UUU | 0.85 | |
| PL3 | HEXADECAN-1-OL | A,B,C,D | 2UUV | 0.85 | |
F09 | NONAN-1-OL | A,C | 2DWD | 0.9 | |
| F09 | NONAN-1-OL | B,C | 1R3L | 0.9 | |
| F09 | NONAN-1-OL | C,H | 1R3I | 0.9 | |
| F09 | NONAN-1-OL | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P,Q,R, S,T,U,V | 1YCE | 0.9 | |
| F09 | NONAN-1-OL | C | 2DWE | 0.9 | |
| F09 | NONAN-1-OL | A,C | 2HVJ | 0.9 | |
| F09 | NONAN-1-OL | B,C | 1R3J | 0.9 | |
| F09 | NONAN-1-OL | C | 1K4D | 0.9 | |
| F09 | NONAN-1-OL | A,C | 1K4C | 0.9 | |
| F09 | NONAN-1-OL | C | 2ATK | 0.9 | |
| F09 | NONAN-1-OL | A,C | 1ZWI | 0.9 | |
| F09 | NONAN-1-OL | A | 1ZNK | 0.9 | |
| F09 | NONAN-1-OL | B,C | 1S5H | 0.9 | |
| F09 | NONAN-1-OL | A,C | 2HVK | 0.9 | |
| F09 | NONAN-1-OL | A,C | 2P7T | 0.9 | |
SDS | DODECYL SULFATE | A,B,C | 1H0J | 0.72 | |
| SDS | DODECYL SULFATE | A | 3B6L | 0.72 | |
N8E | 3,6,9,12,15-PENTAOXATRICOSAN-1- OL | A,B,C | 2W6U | 0.81 | |
| N8E | 3,6,9,12,15-PENTAOXATRICOSAN-1- OL | A,B,C | 2W16 | 0.81 | |
| N8E | 3,6,9,12,15-PENTAOXATRICOSAN-1- OL | A,B,C | 2W76 | 0.81 | |
| N8E | 3,6,9,12,15-PENTAOXATRICOSAN-1- OL | A,B,C | 2W78 | 0.81 | |
| N8E | 3,6,9,12,15-PENTAOXATRICOSAN-1- OL | A,B,C,D | 1WDK | 0.81 | |
| N8E | 3,6,9,12,15-PENTAOXATRICOSAN-1- OL | A,B,C | 2W6T | 0.81 | |
| N8E | 3,6,9,12,15-PENTAOXATRICOSAN-1- OL | A,B | 2W75 | 0.81 | |
| N8E | 3,6,9,12,15-PENTAOXATRICOSAN-1- OL | A | 1TV5 | 0.81 | |
| N8E | 3,6,9,12,15-PENTAOXATRICOSAN-1- OL | A,B | 2O5P | 0.81 | |
| N8E | 3,6,9,12,15-PENTAOXATRICOSAN-1- OL | A,B,C,D | 1WDL | 0.81 | |
| N8E | 3,6,9,12,15-PENTAOXATRICOSAN-1- OL | A,B,C | 2W77 | 0.81 | |
DFD | DECYL FORMATE | A,B | 2QNY | 0.72 | |
| DFD | DECYL FORMATE | A,B | 2QNZ | 0.72 | |
C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A,B | 2R8A | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A,B | 2VQI | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A | 2POR | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A,B,C | 1H35 | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A,B,C | 2F1T | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A,B,D,E | 2GR7 | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A | 5PRN | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A,B | 2QTK | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A | 1PRN | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A | 1HXT | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A | 1GFP | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A | 1NQG | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A | 7PRN | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | X | 3DWO | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A,B,C | 1H39 | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A,B | 2BIX | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A,B,C | 1H3B | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A,B,C | 1O6H | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A | 1QJP | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A,B | 2ODJ | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A | 1GFO | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A,B | 3BRY | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A | 3BRZ | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A | 1GFQ | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A | 2ZFG | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A | 1BXW | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A | 1GFN | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A,B,C | 2O4V | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A,C | 1ETH | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A,B,C | 1O6Q | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | X | 2F1C | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A | 1BH3 | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A,B,C | 1O79 | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A,B,C | 3DZM | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A,B | 2SQC | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A | 8PRN | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A,B,C | 1O6R | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A | 2PRN | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A,B | 3BS0 | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A | 1QJ8 | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A,B,C | 1H3A | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A | 1MPF | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A | 1NQH | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A,B,C | 1GSZ | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A | 1NQE | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A | 1HXX | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A,B,C | 1H37 | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A,B | 1T16 | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A | 1GFM | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A,B | 1GZM | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A | 3PRN | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A | 2OMF | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A,B,C | 1UMP | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A,B,C | 1H36 | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A,B,C | 1H3C | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A | 3C9L | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A | 6PRN | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A | 1NQF | 0.81 | |
| C8E | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE | A | 3POR | 0.81 | |
UDT | O-DECYL HYDROGEN THIOCARBONATE | A,B | 2QNX | 0.7 | |
ARC | 3,7,11,15-TETRAMETHYL-HEXADECAN- 1-OL | A,B,C | 1BRR | 0.72 | |
5HD | 5-(2-hydroxyethyl)nonane-1,9-diol | A | 3DWB | 0.76 | |
C10 | HEXAETHYLENE GLYCOL MONODECYL ETHER | A,B | 2BHI | 0.81 | |
DE1 | DECAN-1-OL | A | 1ZNL | 0.9 | |
HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 2HH1 | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 2UWT | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 2UXK | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 1RZH | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 2HG3 | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 2UX3 | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | A | 2PIL | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | A,B | 1U19 | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 2J8D | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | A,B,C,D | 3DTU | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 2UX4 | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | A,B | 1HZX | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | A,B | 2G87 | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | A,B | 2PED | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | C,H,L,M | 3D38 | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 2UWV | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 1RG5 | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | A | 1KMO | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | C,H,L,M | 1L9B | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 2UWU | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | A | 1AY2 | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | A,B | 1RP0 | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | C,H,L,M | 2I5N | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 2J8C | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 2HJ6 | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 2UXJ | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | L,M | 1YF6 | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | B | 2BF3 | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | A,B | 2HPY | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 2UX5 | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | L,M,X | 2UXM | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 2UXL | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | A,B | 1L9H | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | A | 2HI2 | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | A,B,D,E,G,H, J,K | 1LGH | 0.75 | |
| HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 2UWW | 0.75 | |
BDD | BROMO-DODECANOL | A | 1N8U | 0.75 | |
| BDD | BROMO-DODECANOL | A,B | 1N8V | 0.75 | |
OC9 | OCTAN-1-OL | A | 1ZNH | 0.9 | |
| OC9 | OCTAN-1-OL | A | 2QHV | 0.9 | |
CE9 | DODECYL NONA ETHYLENE GLYCOL ETHER | A | 3DM8 | 0.79 | |
1DO | 1-DODECANOL | A,Z | 2CFZ | 0.9 | |
CE1 | O-DODECANYL OCTAETHYLENE GLYCOL | A,B | 2B7O | 0.79 | |
| CE1 | O-DODECANYL OCTAETHYLENE GLYCOL | A,B,D,M,N,O,P | 1L0V | 0.79 | |
| CE1 | O-DODECANYL OCTAETHYLENE GLYCOL | A,B,D,M,N,O,P | 1KFY | 0.79 | |
| CE1 | O-DODECANYL OCTAETHYLENE GLYCOL | A,B,C,D | 2W1A | 0.79 | |
| CE1 | O-DODECANYL OCTAETHYLENE GLYCOL | A,B,C,M,N,O,P | 1KF6 | 0.79 | |
HND | (4S)-nonane-1,4-diol | A | 2KAR | 0.85 | |
| HND | (4S)-nonane-1,4-diol | A | 2KAS | 0.85 | |
HEZ | HEXANE-1,6-DIOL | A,B | 1X1V | 0.74 | |
| HEZ | HEXANE-1,6-DIOL | A,B,C,D,E,F | 1M8T | 0.74 | |
| HEZ | HEXANE-1,6-DIOL | A | 1J7K | 0.74 | |
| HEZ | HEXANE-1,6-DIOL | A | 2IOR | 0.74 | |
| HEZ | HEXANE-1,6-DIOL | A,D | 2NY2 | 0.74 | |
| HEZ | HEXANE-1,6-DIOL | A | 2NY0 | 0.74 | |
| HEZ | HEXANE-1,6-DIOL | A,B,C,D | 3CDO | 0.74 | |
| HEZ | HEXANE-1,6-DIOL | A,B,C,D | 2NXZ | 0.74 | |
| HEZ | HEXANE-1,6-DIOL | A,D | 2NY4 | 0.74 | |
| HEZ | HEXANE-1,6-DIOL | A | 1P2V | 0.74 | |
| HEZ | HEXANE-1,6-DIOL | A | 1NHZ | 0.74 | |
| HEZ | HEXANE-1,6-DIOL | A,C,D,E,F,G | 2HY6 | 0.74 | |
| HEZ | HEXANE-1,6-DIOL | A | 2NXY | 0.74 | |
| HEZ | HEXANE-1,6-DIOL | A,B | 2VYP | 0.74 | |
| HEZ | HEXANE-1,6-DIOL | A,B | 1JMT | 0.74 | |
| HEZ | HEXANE-1,6-DIOL | A | 1U3C | 0.74 | |
| HEZ | HEXANE-1,6-DIOL | A,B,C,D | 3G36 | 0.74 | |
| HEZ | HEXANE-1,6-DIOL | A,B,C,D | 3EDC | 0.74 | |
| HEZ | HEXANE-1,6-DIOL | A | 1QUH | 0.74 | |
| HEZ | HEXANE-1,6-DIOL | A | 1IN4 | 0.74 | |
| HEZ | HEXANE-1,6-DIOL | A,B,C,D | 1WXW | 0.74 | |
| HEZ | HEXANE-1,6-DIOL | A,B | 3EV1 | 0.74 | |
| HEZ | HEXANE-1,6-DIOL | A,B,D | 2WIW | 0.74 | |
| HEZ | HEXANE-1,6-DIOL | A,B,C,D | 1IBY | 0.74 | |
| HEZ | HEXANE-1,6-DIOL | A | 1QUD | 0.74 | |
HNB | (2S,5R)-5-pentyltetrahydrofuran- 2-ol | A | 2K8T | 0.76 | |
| HNB | (2S,5R)-5-pentyltetrahydrofuran- 2-ol | A | 2K8U | 0.76 | |