Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02316589
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 |
3HD![]() | 3-O-METHYL-O-ALPHA-D-MANNOPYRANOSYL | A | 2HGO | 0.7 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A | 2Z3V | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A,B | 1WOM | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A,B,E,L | 1DIO | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A,B | 1R9E | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A,B,C,D | 2PJM | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A,L | 1EGM | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A | 1K6E | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A | 2RIL | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A,B,C | 3GDH | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A,B | 1EX0 | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A,B,C,D,E,F, G,H | 2OIF | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A,B | 3BXP | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A,B | 2EWG | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A,L | 1EGV | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A | 2IZS | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A,B,C,D | 2V9N | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A,B,N,P | 1HHY | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A,B | 2J1P | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A | 2V9L | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A,B | 1RRM | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A,B | 3BF5 | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A | 1DS1 | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A,B | 2VZ6 | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A,B | 1HQS | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A | 2ODV | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A,B,E,L | 1IWP | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A,B | 3BEM | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A,L | 1EEX | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A | 3BQR | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A | 3D71 | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A,B | 1EVU | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A | 2IZR | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A,B,E,L | 1UC4 | 0.73 | ![]() |
PGO![]() | S-1,2-PROPANEDIOL | A,B | 2E7Y | 0.73 | ![]() |
F09![]() | NONAN-1-OL | A,C | 2DWD | 0.76 | ![]() |
F09![]() | NONAN-1-OL | B,C | 1R3L | 0.76 | ![]() |
F09![]() | NONAN-1-OL | C,H | 1R3I | 0.76 | ![]() |
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 | 0.76 | ![]() |
F09![]() | NONAN-1-OL | C | 2DWE | 0.76 | ![]() |
F09![]() | NONAN-1-OL | A,C | 2HVJ | 0.76 | ![]() |
F09![]() | NONAN-1-OL | B,C | 1R3J | 0.76 | ![]() |
F09![]() | NONAN-1-OL | C | 1K4D | 0.76 | ![]() |
F09![]() | NONAN-1-OL | A,C | 1K4C | 0.76 | ![]() |
F09![]() | NONAN-1-OL | C | 2ATK | 0.76 | ![]() |
F09![]() | NONAN-1-OL | A,C | 1ZWI | 0.76 | ![]() |
F09![]() | NONAN-1-OL | A | 1ZNK | 0.76 | ![]() |
F09![]() | NONAN-1-OL | B,C | 1S5H | 0.76 | ![]() |
F09![]() | NONAN-1-OL | A,C | 2HVK | 0.76 | ![]() |
F09![]() | NONAN-1-OL | A,C | 2P7T | 0.76 | ![]() |
PGR![]() | R-1,2-PROPANEDIOL | A,B | 3BXP | 0.73 | ![]() |
PGR![]() | R-1,2-PROPANEDIOL | A,B,C,P | 1HHZ | 0.73 | ![]() |
PGR![]() | R-1,2-PROPANEDIOL | A | 2PC0 | 0.73 | ![]() |
PGR![]() | R-1,2-PROPANEDIOL | A,B,C | 3GDH | 0.73 | ![]() |
PGR![]() | R-1,2-PROPANEDIOL | A | 2VBK | 0.73 | ![]() |
PGR![]() | R-1,2-PROPANEDIOL | A,B | 1HQS | 0.73 | ![]() |
PGR![]() | R-1,2-PROPANEDIOL | A | 1YIQ | 0.73 | ![]() |
PGR![]() | R-1,2-PROPANEDIOL | A | 3EO7 | 0.73 | ![]() |
PGR![]() | R-1,2-PROPANEDIOL | A | 1REM | 0.73 | ![]() |
PGR![]() | R-1,2-PROPANEDIOL | A | 2V2B | 0.73 | ![]() |
PGR![]() | R-1,2-PROPANEDIOL | A,B,E,L | 1UC5 | 0.73 | ![]() |
PGR![]() | R-1,2-PROPANEDIOL | A | 2HB4 | 0.73 | ![]() |
MQD![]() | 2-METHYLPENTANE-1,2,4-TRIOL | A,B | 1OAD | 0.72 | ![]() |
INS![]() | 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE | A | 3BXD | 0.73 | ![]() |
INS![]() | 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE | A | 1IEV | 0.73 | ![]() |
INS![]() | 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE | A | 1PTG | 0.73 | ![]() |
INS![]() | 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE | A,B,C | 2OS9 | 0.73 | ![]() |
INS![]() | 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE | A,B,C,D | 2R71 | 0.73 | ![]() |
INS![]() | 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE | A,B | 1G0I | 0.73 | ![]() |
INS![]() | 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE | A | 2HUO | 0.73 | ![]() |
INS![]() | 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE | A,B | 1Y7V | 0.73 | ![]() |
INS![]() | 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE | A | 1AOD | 0.73 | ![]() |
INS![]() | 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE | A,B | 3EA2 | 0.73 | ![]() |
PE9![]() | PENTAN-1-OL | A | 1ZND | 0.7 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | H,L,M | 2HH1 | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | H,L,M | 2UWT | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | H,L,M | 2UXK | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | H,L,M | 1RZH | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | H,L,M | 2HG3 | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | H,L,M | 2UX3 | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | A | 2PIL | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | A,B | 1U19 | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | H,L,M | 2J8D | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | A,B,C,D | 3DTU | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | H,L,M | 2UX4 | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | A,B | 1HZX | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | A,B | 2G87 | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | A,B | 2PED | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | C,H,L,M | 3D38 | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | H,L,M | 2UWV | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | H,L,M | 1RG5 | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | A | 1KMO | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | C,H,L,M | 1L9B | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | H,L,M | 2UWU | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | A | 1AY2 | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | A,B | 1RP0 | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | C,H,L,M | 2I5N | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | H,L,M | 2J8C | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | H,L,M | 2HJ6 | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | H,L,M | 2UXJ | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | L,M | 1YF6 | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | B | 2BF3 | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | A,B | 2HPY | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | H,L,M | 2UX5 | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | L,M,X | 2UXM | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | H,L,M | 2UXL | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | A,B | 1L9H | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | A | 2HI2 | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | A,B,D,E,G,H, J,K | 1LGH | 0.94 | ![]() |
HTO![]() | HEPTANE-1,2,3-TRIOL | H,L,M | 2UWW | 0.94 | ![]() |
CBU![]() | (1R,2R,3S,4S,5S,6S)-CYCLOHEXANE- 1,2,3,4,5,6-HEXOL | A,B | 2VT0 | 0.73 | ![]() |
MTL![]() | D-MANNITOL | A,B | 1ZZU | 0.77 | ![]() |
MTL![]() | D-MANNITOL | A,B | 1ZZQ | 0.77 | ![]() |
MTL![]() | D-MANNITOL | A,B | 1M2W | 0.77 | ![]() |
MTL![]() | D-MANNITOL | A | 2VFU | 0.77 | ![]() |
FOC![]() | FUCITOL | A,B,C,D,E,F | 1FUI | 0.8 | ![]() |
FU4![]() | 2,6-ANHYDRO-1-DEOXY-D-GALACTITOL | A | 2OBD | 0.74 | ![]() |
FU4![]() | 2,6-ANHYDRO-1-DEOXY-D-GALACTITOL | A,D | 2IWG | 0.74 | ![]() |
ODI![]() | OCTANE-1,8-DIOL | A | 2DM5 | 0.76 | ![]() |
XYL![]() | D-XYLITOL | A,B | 1XLC | 0.74 | ![]() |
XYL![]() | D-XYLITOL | A | 1S5N | 0.74 | ![]() |
XYL![]() | D-XYLITOL | A | 1W3Y | 0.74 | ![]() |
XYL![]() | D-XYLITOL | A | 1NJR | 0.74 | ![]() |
XYL![]() | D-XYLITOL | G,H,L | 2B4C | 0.74 | ![]() |
XYL![]() | D-XYLITOL | A,B | 1FX5 | 0.74 | ![]() |
XYL![]() | D-XYLITOL | A,B | 1XLM | 0.74 | ![]() |
XYL![]() | D-XYLITOL | A,B,C,D | 1XIN | 0.74 | ![]() |
XYL![]() | D-XYLITOL | A,B,C,D | 2XIM | 0.74 | ![]() |
XYL![]() | D-XYLITOL | A | 2VFS | 0.74 | ![]() |
XYL![]() | D-XYLITOL | A,B,C,D | 1XIM | 0.74 | ![]() |
XYL![]() | D-XYLITOL | A | 2XIS | 0.74 | ![]() |
XYL![]() | D-XYLITOL | A,B | 1XLG | 0.74 | ![]() |
XYL![]() | D-XYLITOL | A,B | 1XLD | 0.74 | ![]() |
XYL![]() | D-XYLITOL | A | 1LTE | 0.74 | ![]() |
XYL![]() | D-XYLITOL | A,B | 1XLJ | 0.74 | ![]() |
XYL![]() | D-XYLITOL | A | 1XIG | 0.74 | ![]() |
XYL![]() | D-XYLITOL | A,B | 5XIA | 0.74 | ![]() |
HND![]() | (4S)-nonane-1,4-diol | A | 2KAR | 0.82 | ![]() |
HND![]() | (4S)-nonane-1,4-diol | A | 2KAS | 0.82 | ![]() |
HE2![]() | HEXAN-1-OL | A | 1ZNE | 0.77 | ![]() |
BU2![]() | 1,3-BUTANEDIOL | A,B | 1LOL | 0.71 | ![]() |
BU2![]() | 1,3-BUTANEDIOL | A,B | 2RFM | 0.71 | ![]() |
1DO![]() | 1-DODECANOL | A,Z | 2CFZ | 0.76 | ![]() |
PL3![]() | HEXADECAN-1-OL | A,B,C,D | 2UUU | 0.71 | ![]() |
PL3![]() | HEXADECAN-1-OL | A,B,C,D | 2UUV | 0.71 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A,B | 1X1V | 0.77 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A,B,C,D,E,F | 1M8T | 0.77 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A | 1J7K | 0.77 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A | 2IOR | 0.77 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A,D | 2NY2 | 0.77 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A | 2NY0 | 0.77 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A,B,C,D | 3CDO | 0.77 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A,B,C,D | 2NXZ | 0.77 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A,D | 2NY4 | 0.77 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A | 1P2V | 0.77 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A | 1NHZ | 0.77 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A,C,D,E,F,G | 2HY6 | 0.77 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A | 2NXY | 0.77 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A,B | 2VYP | 0.77 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A,B | 1JMT | 0.77 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A | 1U3C | 0.77 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A,B,C,D | 3G36 | 0.77 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A,B,C,D | 3EDC | 0.77 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A | 1QUH | 0.77 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A | 1IN4 | 0.77 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A,B,C,D | 1WXW | 0.77 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A,B | 3EV1 | 0.77 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A,B,D | 2WIW | 0.77 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A,B,C,D | 1IBY | 0.77 | ![]() |
HEZ![]() | HEXANE-1,6-DIOL | A | 1QUD | 0.77 | ![]() |
CXL![]() | CYCLOHEXANOL | A,B | 1HDX | 0.75 | ![]() |
DE1![]() | DECAN-1-OL | A | 1ZNL | 0.76 | ![]() |
SOR![]() | D-SORBITOL | A | 1FQA | 0.77 | ![]() |
SOR![]() | D-SORBITOL | A,B,C,D | 3XIM | 0.77 | ![]() |
SOR![]() | D-SORBITOL | A | 2VFT | 0.77 | ![]() |
SOR![]() | D-SORBITOL | A,B,C,D | 5XIM | 0.77 | ![]() |
SOR![]() | D-SORBITOL | A | 3BRF | 0.77 | ![]() |
SOR![]() | D-SORBITOL | A | 1XIH | 0.77 | ![]() |
SOR![]() | D-SORBITOL | A | 2DXR | 0.77 | ![]() |
SOR![]() | D-SORBITOL | A | 1D8C | 0.77 | ![]() |
SOR![]() | D-SORBITOL | A,B,C,D | 2XIN | 0.77 | ![]() |
SOR![]() | D-SORBITOL | A | 1FQB | 0.77 | ![]() |
SOR![]() | D-SORBITOL | A,B | 4XIA | 0.77 | ![]() |
RNT![]() | L-RHAMNITOL | A,B,C,D | 1DE5 | 0.8 | ![]() |
OC9![]() | OCTAN-1-OL | A | 1ZNH | 0.76 | ![]() |
OC9![]() | OCTAN-1-OL | A | 2QHV | 0.76 | ![]() |
BU3![]() | (R,R)-2,3-BUTANEDIOL | A,B | 2CL5 | 0.77 | ![]() |
BU3![]() | (R,R)-2,3-BUTANEDIOL | A | 1Z2U | 0.77 | ![]() |
BU3![]() | (R,R)-2,3-BUTANEDIOL | A,B | 1SMH | 0.77 | ![]() |
BU3![]() | (R,R)-2,3-BUTANEDIOL | A | 1XH9 | 0.77 | ![]() |
BU3![]() | (R,R)-2,3-BUTANEDIOL | A,B,C,D,E,F, G,H | 2F9P | 0.77 | ![]() |
BU3![]() | (R,R)-2,3-BUTANEDIOL | A | 2H90 | 0.77 | ![]() |
BU3![]() | (R,R)-2,3-BUTANEDIOL | A,B,C,D,E,F, G,H | 2F9N | 0.77 | ![]() |
BU3![]() | (R,R)-2,3-BUTANEDIOL | A,B | 1XH5 | 0.77 | ![]() |
HE4![]() | HEPTAN-1-OL | A | 1ZNG | 0.81 | ![]() |