Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02365442
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 |
2MP | 3,4-DIMETHYLPHENOL | A | 1L5O | 0.72 | |
PIT | PICEATANNOL | A,B,C,D,E,F, G,H,I,J,K,L, M,N | 2JJ1 | 0.78 | |
ETY | 4-ethylphenol | A,B,C,D | 2RA6 | 0.71 | |
ZTW | RALOXIFENE CORE | A,B | 1GWQ | 0.74 | |
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 | |
PCR | P-CRESOL | A | 1JHV | 0.71 | |
PCR | P-CRESOL | A | 1JHU | 0.71 | |
PCR | P-CRESOL | A,B,C,D | 1DIQ | 0.71 | |
1OH | 4-(1-methyl-1-phenylethyl)phenol | A | 2ZAS | 0.71 | |
LZ2 | 5-hydroxynaphthalene-1-sulfonamide | A | 2VTH | 0.76 | |
CRS | M-CRESOL | A,B,C,D | 1EV3 | 0.72 | |
CRS | M-CRESOL | A,B,C,D,E,F | 2OMG | 0.72 | |
CRS | M-CRESOL | A,B | 1UZ9 | 0.72 | |
CRS | M-CRESOL | A,B,C,D | 1ZEH | 0.72 | |
CRS | M-CRESOL | A,B,C,D,E,F | 1ZEI | 0.72 | |
CRS | M-CRESOL | A,C,D,E | 7INS | 0.72 | |
CRS | M-CRESOL | A,B,C,D,E,G, I,K | 1EV6 | 0.72 | |
DHC | CAFFEIC ACID | A,B,C,D,E,F, G,H | 2O7D | 0.74 | |
DHC | CAFFEIC ACID | A | 1KOU | 0.74 | |
DES | DIETHYLSTILBESTROL | A,B,C,D | 1S9P | 0.73 | |
DES | DIETHYLSTILBESTROL | A,B | 3ERD | 0.73 | |
DES | DIETHYLSTILBESTROL | A,B | 1TT6 | 0.73 | |
DES | DIETHYLSTILBESTROL | A,B,C,D | 1TZ8 | 0.73 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A | 2QU9 | 0.72 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1QLU | 0.72 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1J | 0.72 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 2VAO | 0.72 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1K | 0.72 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1DZN | 0.72 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1L | 0.72 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1M | 0.72 | |
BP7 | 1,1'-BIPHENYL-3,4-DIOL | A | 2EI0 | 0.78 | |
BP3 | 2'-CHLORO-BIPHENYL-2,3-DIOL | A | 1LGT | 0.7 | |
226 | naphthalene-1,2,4,5,7-pentol | A,B | 2NZ5 | 0.7 | |
5PP | 5-PENTYL-2-PHENOXYPHENOL | A,B,C,D,E,F | 2B36 | 0.7 | |
8PS | 5-OCTYL-2-PHENOXYPHENOL | A,B,C,D,E,F | 2B37 | 0.7 | |
D1N | NAPHTHALENE-1,2-DIOL | A | 2EI1 | 0.75 | |
W29 | 4-(3-ethylthiophen-2-yl)benzene- 1,2-diol | A | 3D27 | 0.81 | |
HXS | 4-[(1R,2S)-1-ethyl-2-(4-hydroxyphenyl)butyl]phenol | A,B | 3CV6 | 0.72 | |
DYS | S-[5-(2-aminoethyl)-2,3-dihydroxyphenyl]- L-cysteine | B | 2R1T | 0.73 | |
AZN | ALIZARIN RED | H,I,J,K,L,M, N,O | 1OAR | 0.71 | |
MCT | 4-METHYLCATECHOL | A | 1L4G | 0.78 | |
MCT | 4-METHYLCATECHOL | A | 2EHZ | 0.78 | |
MCT | 4-METHYLCATECHOL | A,B | 1DMH | 0.78 | |
HSP | 4-(2-HYDROXYPHENYLSULFINYL)-BUTYLPHOSPHONIC ACID | A,B | 1CW2 | 0.74 | |
OBP | A,B | 2DE3 | 0.76 | ||
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 | |
MBD | 3-METHYLCATECHOL | A | 1KNF | 0.76 | |
HE1 | 4-(2-HYDROXYPHENYLTHIO)-1-BUTENYLPHOSPHONIC ACID | A,B | 1C8V | 0.71 | |
HE1 | 4-(2-HYDROXYPHENYLTHIO)-1-BUTENYLPHOSPHONIC ACID | A,B | 1C29 | 0.71 | |
178 | 4-(4-HYDROXY-3-ISOPROPYLPHENYLTHIO)- 2-ISOPROPYLPHENOL | A,B | 1TVE | 0.79 | |
2OH | 4,4'-PROPANE-2,2-DIYLDIPHENOL | A | 2E2R | 0.72 | |
2OH | 4,4'-PROPANE-2,2-DIYLDIPHENOL | A | 2P7G | 0.72 |