Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02364603
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 |
BU1![]() | 1,4-BUTANEDIOL | A | 2BAB | 0.87 | ![]() |
BU1![]() | 1,4-BUTANEDIOL | A,B | 2HW8 | 0.87 | ![]() |
BU1![]() | 1,4-BUTANEDIOL | A | 2B9Y | 0.87 | ![]() |
BU1![]() | 1,4-BUTANEDIOL | A | 1M8R | 0.87 | ![]() |
BU1![]() | 1,4-BUTANEDIOL | A,B,C | 3FNK | 0.87 | ![]() |
BU1![]() | 1,4-BUTANEDIOL | A,B | 1TZP | 0.87 | ![]() |
BU1![]() | 1,4-BUTANEDIOL | A | 1M8S | 0.87 | ![]() |
BU1![]() | 1,4-BUTANEDIOL | A | 1VIO | 0.87 | ![]() |
BU1![]() | 1,4-BUTANEDIOL | A | 2W62 | 0.87 | ![]() |
BU1![]() | 1,4-BUTANEDIOL | A | 2RH1 | 0.87 | ![]() |
BU1![]() | 1,4-BUTANEDIOL | A,B,C | 3CED | 0.87 | ![]() |
BU1![]() | 1,4-BUTANEDIOL | A | 1BK9 | 0.87 | ![]() |
BU1![]() | 1,4-BUTANEDIOL | A | 1X9D | 0.87 | ![]() |
PG0![]() | 2-(2-METHOXYETHOXY)ETHANOL | A,B | 3CN9 | 0.73 | ![]() |
PG0![]() | 2-(2-METHOXYETHOXY)ETHANOL | A | 2GLA | 0.73 | ![]() |
PG0![]() | 2-(2-METHOXYETHOXY)ETHANOL | A | 2VJI | 0.73 | ![]() |
PG0![]() | 2-(2-METHOXYETHOXY)ETHANOL | A | 2CU9 | 0.73 | ![]() |
BU2![]() | 1,3-BUTANEDIOL | A,B | 1LOL | 0.77 | ![]() |
BU2![]() | 1,3-BUTANEDIOL | A,B | 2RFM | 0.77 | ![]() |
POL![]() | N-PROPANOL | A,B | 1AL4 | 0.74 | ![]() |
POL![]() | N-PROPANOL | A | 2Q1P | 0.74 | ![]() |
POL![]() | N-PROPANOL | A,B,C,D,E | 3DWQ | 0.74 | ![]() |
POL![]() | N-PROPANOL | A | 1JSE | 0.74 | ![]() |
POL![]() | N-PROPANOL | A,B | 1OOG | 0.74 | ![]() |
POL![]() | N-PROPANOL | A,B | 3CL1 | 0.74 | ![]() |
HE2![]() | HEXAN-1-OL | A | 1ZNE | 0.7 | ![]() |
AE3![]() | 2-(2-ETHOXYETHOXY)ETHANOL | A,B | 2C2N | 0.73 | ![]() |
AE3![]() | 2-(2-ETHOXYETHOXY)ETHANOL | A,B | 2JGH | 0.73 | ![]() |
AE3![]() | 2-(2-ETHOXYETHOXY)ETHANOL | A,B | 2JGJ | 0.73 | ![]() |
AE3![]() | 2-(2-ETHOXYETHOXY)ETHANOL | A,B,C | 2JHE | 0.73 | ![]() |
AE3![]() | 2-(2-ETHOXYETHOXY)ETHANOL | A,B | 1J06 | 0.73 | ![]() |
AE3![]() | 2-(2-ETHOXYETHOXY)ETHANOL | A,B | 2JGI | 0.73 | ![]() |
ETX![]() | 2-ETHOXYETHANOL | A,B | 2D1G | 0.73 | ![]() |
ETX![]() | 2-ETHOXYETHANOL | A | 3BBY | 0.73 | ![]() |
ETX![]() | 2-ETHOXYETHANOL | A,B | 1R37 | 0.73 | ![]() |
ETX![]() | 2-ETHOXYETHANOL | A,B,C,D | 2VZY | 0.73 | ![]() |
ETX![]() | 2-ETHOXYETHANOL | A,H,L,U | 2FD6 | 0.73 | ![]() |
ETX![]() | 2-ETHOXYETHANOL | A | 2GNO | 0.73 | ![]() |
ETX![]() | 2-ETHOXYETHANOL | A,B,H | 3GBN | 0.73 | ![]() |
ETX![]() | 2-ETHOXYETHANOL | A,B | 3DT7 | 0.73 | ![]() |
ETX![]() | 2-ETHOXYETHANOL | A,B | 2R7H | 0.73 | ![]() |
ETX![]() | 2-ETHOXYETHANOL | A | 2HX5 | 0.73 | ![]() |
ETX![]() | 2-ETHOXYETHANOL | A,B,C,D | 3E49 | 0.73 | ![]() |
ETX![]() | 2-ETHOXYETHANOL | A,C | 3BYB | 0.73 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A,B | 1X1V | 0.7 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A,B,C,D,E,F | 1M8T | 0.7 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A | 1J7K | 0.7 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A | 2IOR | 0.7 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A,D | 2NY2 | 0.7 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A | 2NY0 | 0.7 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A,B,C,D | 3CDO | 0.7 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A,B,C,D | 2NXZ | 0.7 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A,D | 2NY4 | 0.7 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A | 1P2V | 0.7 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A | 1NHZ | 0.7 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A,C,D,E,F,G | 2HY6 | 0.7 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A | 2NXY | 0.7 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A,B | 2VYP | 0.7 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A,B | 1JMT | 0.7 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A | 1U3C | 0.7 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A,B,C,D | 3G36 | 0.7 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A,B,C,D | 3EDC | 0.7 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A | 1QUH | 0.7 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A | 1IN4 | 0.7 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A,B,C,D | 1WXW | 0.7 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A,B | 3EV1 | 0.7 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A,B,D | 2WIW | 0.7 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A,B,C,D | 1IBY | 0.7 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A | 1QUD | 0.7 | ![]() |
1BO![]() | 1-BUTANOL | X | 1YKY | 0.83 | ![]() |
1BO![]() | 1-BUTANOL | A,B | 2HUU | 0.83 | ![]() |
1BO![]() | 1-BUTANOL | A | 2VDG | 0.83 | ![]() |
1BO![]() | 1-BUTANOL | A,B | 1OOH | 0.83 | ![]() |
1BO![]() | 1-BUTANOL | C,D | 1OKX | 0.83 | ![]() |
1BO![]() | 1-BUTANOL | A,B | 3ET2 | 0.83 | ![]() |
1BO![]() | 1-BUTANOL | A,B | 3B6X | 0.83 | ![]() |
1BO![]() | 1-BUTANOL | A | 1G4H | 0.83 | ![]() |
1BO![]() | 1-BUTANOL | A,B | 2HUF | 0.83 | ![]() |
IP3![]() | 1-HYDROXY-3-METHYLBUTANE | A,B | 1HRN | 0.73 | ![]() |
IP3![]() | 1-HYDROXY-3-METHYLBUTANE | A,B | 1BIL | 0.73 | ![]() |
PE9![]() | PENTAN-1-OL | A | 1ZND | 0.76 | ![]() |
BU3![]() | (R,R)-2,3-BUTANEDIOL | A,B | 2CL5 | 0.7 | ![]() |
BU3![]() | (R,R)-2,3-BUTANEDIOL | A | 1Z2U | 0.7 | ![]() |
BU3![]() | (R,R)-2,3-BUTANEDIOL | A,B | 1SMH | 0.7 | ![]() |
BU3![]() | (R,R)-2,3-BUTANEDIOL | A | 1XH9 | 0.7 | ![]() |
BU3![]() | (R,R)-2,3-BUTANEDIOL | A,B,C,D,E,F, G,H | 2F9P | 0.7 | ![]() |
BU3![]() | (R,R)-2,3-BUTANEDIOL | A | 2H90 | 0.7 | ![]() |
BU3![]() | (R,R)-2,3-BUTANEDIOL | A,B,C,D,E,F, G,H | 2F9N | 0.7 | ![]() |
BU3![]() | (R,R)-2,3-BUTANEDIOL | A,B | 1XH5 | 0.7 | ![]() |
PDO![]() | 1,3-PROPANDIOL | A | 1ZV9 | 0.71 | ![]() |
PDO![]() | 1,3-PROPANDIOL | A | 1NAI | 0.71 | ![]() |
PDO![]() | 1,3-PROPANDIOL | F | 1MR3 | 0.71 | ![]() |
PDO![]() | 1,3-PROPANDIOL | A,B,C | 3FNK | 0.71 | ![]() |
PDO![]() | 1,3-PROPANDIOL | A | 2O2I | 0.71 | ![]() |
PDO![]() | 1,3-PROPANDIOL | A | 1D07 | 0.71 | ![]() |
PDO![]() | 1,3-PROPANDIOL | A | 1IZ8 | 0.71 | ![]() |
PDO![]() | 1,3-PROPANDIOL | A,H | 1BTW | 0.71 | ![]() |
SBT![]() | 2-BUTANOL | A,B,C,D | 1BXZ | 0.72 | ![]() |
SBT![]() | 2-BUTANOL | A | 2PLH | 0.72 | ![]() |