Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02522132
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 |
PIT![]() | PICEATANNOL | A,B,C,D,E,F, G,H,I,J,K,L, M,N | 2JJ1 | 0.78 | ![]() |
MBD![]() | 3-METHYLCATECHOL | A | 1KNF | 0.74 | ![]() |
LDP![]() | L-DOPAMINE | A,B | 2A3R | 0.72 | ![]() |
LDP![]() | L-DOPAMINE | A | 5PAH | 0.72 | ![]() |
LDP![]() | L-DOPAMINE | A,B | 2QMZ | 0.72 | ![]() |
LDP![]() | L-DOPAMINE | A,B | 2VQ5 | 0.72 | ![]() |
BPY![]() | BIPHENYL-2,3-DIOL | A | 1KMY | 0.77 | ![]() |
BPY![]() | BIPHENYL-2,3-DIOL | B | 1KW8 | 0.77 | ![]() |
BPY![]() | BIPHENYL-2,3-DIOL | A | 2EI3 | 0.77 | ![]() |
BPY![]() | BIPHENYL-2,3-DIOL | A | 1EIR | 0.77 | ![]() |
BPY![]() | BIPHENYL-2,3-DIOL | B | 1KW6 | 0.77 | ![]() |
BPY![]() | BIPHENYL-2,3-DIOL | B | 1KWC | 0.77 | ![]() |
BPY![]() | BIPHENYL-2,3-DIOL | B | 1KW9 | 0.77 | ![]() |
2C7![]() | 2-(cycloheptylmethyl)-1,1-dioxido- 1-benzothiophen-6-yl sulfamate | A | 3DD8 | 0.71 | ![]() |
ZTW![]() | RALOXIFENE CORE | A,B | 1GWQ | 0.73 | ![]() |
2MP![]() | 3,4-DIMETHYLPHENOL | A | 1L5O | 0.7 | ![]() |
LZ2![]() | 5-hydroxynaphthalene-1-sulfonamide | A | 2VTH | 0.76 | ![]() |
DHC![]() | CAFFEIC ACID | A,B,C,D,E,F, G,H | 2O7D | 0.74 | ![]() |
DHC![]() | CAFFEIC ACID | A | 1KOU | 0.74 | ![]() |
HSP![]() | 4-(2-HYDROXYPHENYLSULFINYL)-BUTYLPHOSPHONIC ACID | A,B | 1CW2 | 0.71 | ![]() |
BP7![]() | 1,1'-BIPHENYL-3,4-DIOL | A | 2EI0 | 0.78 | ![]() |
BP3![]() | 2'-CHLORO-BIPHENYL-2,3-DIOL | A | 1LGT | 0.7 | ![]() |
EUG![]() | 2-METHOXY-4-VINYL-PHENOL | A | 2QU9 | 0.7 | ![]() |
EUG![]() | 2-METHOXY-4-VINYL-PHENOL | A,B | 1QLU | 0.7 | ![]() |
EUG![]() | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1J | 0.7 | ![]() |
EUG![]() | 2-METHOXY-4-VINYL-PHENOL | A,B | 2VAO | 0.7 | ![]() |
EUG![]() | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1K | 0.7 | ![]() |
EUG![]() | 2-METHOXY-4-VINYL-PHENOL | A,B | 1DZN | 0.7 | ![]() |
EUG![]() | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1L | 0.7 | ![]() |
EUG![]() | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1M | 0.7 | ![]() |
226![]() | naphthalene-1,2,4,5,7-pentol | A,B | 2NZ5 | 0.7 | ![]() |
CRS![]() | M-CRESOL | A,B,C,D | 1EV3 | 0.7 | ![]() |
CRS![]() | M-CRESOL | A,B,C,D,E,F | 2OMG | 0.7 | ![]() |
CRS![]() | M-CRESOL | A,B | 1UZ9 | 0.7 | ![]() |
CRS![]() | M-CRESOL | A,B,C,D | 1ZEH | 0.7 | ![]() |
CRS![]() | M-CRESOL | A,B,C,D,E,F | 1ZEI | 0.7 | ![]() |
CRS![]() | M-CRESOL | A,C,D,E | 7INS | 0.7 | ![]() |
CRS![]() | M-CRESOL | A,B,C,D,E,G, I,K | 1EV6 | 0.7 | ![]() |
MCT![]() | 4-METHYLCATECHOL | A | 1L4G | 0.77 | ![]() |
MCT![]() | 4-METHYLCATECHOL | A | 2EHZ | 0.77 | ![]() |
MCT![]() | 4-METHYLCATECHOL | A,B | 1DMH | 0.77 | ![]() |
HXS![]() | 4-[(1R,2S)-1-ethyl-2-(4-hydroxyphenyl)butyl]phenol | A,B | 3CV6 | 0.7 | ![]() |
DES![]() | DIETHYLSTILBESTROL | A,B,C,D | 1S9P | 0.71 | ![]() |
DES![]() | DIETHYLSTILBESTROL | A,B | 3ERD | 0.71 | ![]() |
DES![]() | DIETHYLSTILBESTROL | A,B | 1TT6 | 0.71 | ![]() |
DES![]() | DIETHYLSTILBESTROL | A,B,C,D | 1TZ8 | 0.71 | ![]() |
D1N![]() | NAPHTHALENE-1,2-DIOL | A | 2EI1 | 0.75 | ![]() |
F16![]() | 5-(3-HYDROXYPHENYL)ISOTHIAZOL-3(2H)- ONE 1,1-DIOXIDE | A | 2CM8 | 0.71 | ![]() |
OBP![]() | A,B | 2DE3 | 0.76 | ![]() | |
178![]() | 4-(4-HYDROXY-3-ISOPROPYLPHENYLTHIO)- 2-ISOPROPYLPHENOL | A,B | 1TVE | 0.76 | ![]() |
2OH![]() | 4,4'-PROPANE-2,2-DIYLDIPHENOL | A | 2E2R | 0.7 | ![]() |
2OH![]() | 4,4'-PROPANE-2,2-DIYLDIPHENOL | A | 2P7G | 0.7 | ![]() |
STL![]() | RESVERATROL | A,B | 3CKL | 0.72 | ![]() |
STL![]() | RESVERATROL | A,B,C,D | 1U0W | 0.72 | ![]() |
STL![]() | RESVERATROL | A | 1CGZ | 0.72 | ![]() |
STL![]() | RESVERATROL | A,B,C,D,E,F, G,H,I,J,K,L, M,N | 2JIZ | 0.72 | ![]() |
STL![]() | RESVERATROL | A | 1Z1F | 0.72 | ![]() |
STL![]() | RESVERATROL | A | 1DVS | 0.72 | ![]() |
STL![]() | RESVERATROL | A,B | 1SG0 | 0.72 | ![]() |
DYS![]() | S-[5-(2-aminoethyl)-2,3-dihydroxyphenyl]- L-cysteine | B | 2R1T | 0.7 | ![]() |
W29![]() | 4-(3-ethylthiophen-2-yl)benzene- 1,2-diol | A | 3D27 | 0.8 | ![]() |