Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02372273
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 |
STL![]() | RESVERATROL | A,B | 3CKL | 0.82 | ![]() |
STL![]() | RESVERATROL | A,B,C,D | 1U0W | 0.82 | ![]() |
STL![]() | RESVERATROL | A | 1CGZ | 0.82 | ![]() |
STL![]() | RESVERATROL | A,B,C,D,E,F, G,H,I,J,K,L, M,N | 2JIZ | 0.82 | ![]() |
STL![]() | RESVERATROL | A | 1Z1F | 0.82 | ![]() |
STL![]() | RESVERATROL | A | 1DVS | 0.82 | ![]() |
STL![]() | RESVERATROL | A,B | 1SG0 | 0.82 | ![]() |
TH0![]() | 4-MERCAPTOBENZENE-1,3-DIOL | A | 2OSF | 0.73 | ![]() |
DIN![]() | 1,6-DIHYDROXY NAPHTHALENE | A | 1ZB6 | 0.72 | ![]() |
MBD![]() | 3-METHYLCATECHOL | A | 1KNF | 0.74 | ![]() |
BTT![]() | BENZENE-1,2,4,5-TETROL | A,B,C,D,E,F, G,H,I,J,K,L | 1TI6 | 0.71 | ![]() |
BTT![]() | BENZENE-1,2,4,5-TETROL | M,N,O,P,Q,R, S,T,U,V,W,X | 1VLF | 0.71 | ![]() |
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 | ![]() |
ZTW![]() | RALOXIFENE CORE | A,B | 1GWQ | 0.73 | ![]() |
2MP![]() | 3,4-DIMETHYLPHENOL | A | 1L5O | 0.7 | ![]() |
DHC![]() | CAFFEIC ACID | A,B,C,D,E,F, G,H | 2O7D | 0.74 | ![]() |
DHC![]() | CAFFEIC ACID | A | 1KOU | 0.74 | ![]() |
178![]() | 4-(4-HYDROXY-3-ISOPROPYLPHENYLTHIO)- 2-ISOPROPYLPHENOL | A,B | 1TVE | 0.78 | ![]() |
BP7![]() | 1,1'-BIPHENYL-3,4-DIOL | A | 2EI0 | 0.78 | ![]() |
BP3![]() | 2'-CHLORO-BIPHENYL-2,3-DIOL | A | 1LGT | 0.7 | ![]() |
HFL![]() | 5-(3,3-DIHYDROXYPROPENY)-3-METHOXY- BENZENE-1,2-DIOL | C,F | 1KYW | 0.73 | ![]() |
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 | ![]() |
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 | ![]() |
PIT![]() | PICEATANNOL | A,B,C,D,E,F, G,H,I,J,K,L, M,N | 2JJ1 | 0.87 | ![]() |
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 | ![]() |
S24![]() | S-(2,4-dihydroxyphenyl) hydrogen thiocarbonate | A | 2OSF | 0.76 | ![]() |
SXX![]() | SINAPINATE | A,B | 1WB4 | 0.71 | ![]() |
OBP![]() | A,B | 2DE3 | 0.71 | ![]() | |
2OH![]() | 4,4'-PROPANE-2,2-DIYLDIPHENOL | A | 2E2R | 0.7 | ![]() |
2OH![]() | 4,4'-PROPANE-2,2-DIYLDIPHENOL | A | 2P7G | 0.7 | ![]() |
W29![]() | 4-(3-ethylthiophen-2-yl)benzene- 1,2-diol | A | 3D27 | 0.83 | ![]() |
226![]() | naphthalene-1,2,4,5,7-pentol | A,B | 2NZ5 | 0.79 | ![]() |
PYG![]() | BENZENE-1,2,3-TRIOL | A,B,C,D,E,F, G,H,I,J,K,L | 1TI4 | 0.73 | ![]() |
PYG![]() | BENZENE-1,2,3-TRIOL | M,N,O,P,Q,R, S,T,U,V,W,X | 1VLE | 0.73 | ![]() |
DYS![]() | S-[5-(2-aminoethyl)-2,3-dihydroxyphenyl]- L-cysteine | B | 2R1T | 0.7 | ![]() |
HE1![]() | 4-(2-HYDROXYPHENYLTHIO)-1-BUTENYLPHOSPHONIC ACID | A,B | 1C8V | 0.71 | ![]() |
HE1![]() | 4-(2-HYDROXYPHENYLTHIO)-1-BUTENYLPHOSPHONIC ACID | A,B | 1C29 | 0.71 | ![]() |
SN1![]() | 2,4-DIHYDROXY-TRANS CINNAMIC ACID | 1 | 1K2I | 0.72 | ![]() |
DHY![]() | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | M,N,O,P,Q,R | 3PCN | 0.71 | ![]() |
DHY![]() | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | B | 1AI4 | 0.71 | ![]() |
DHY![]() | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | A,B,C,D | 1Q0C | 0.71 | ![]() |
DHY![]() | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | A,B | 1F1V | 0.71 | ![]() |