Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03537192
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 |
NE1 | 2',3,3',4',5-PENTACHLOROBIPHENYL- 4-OL | A,B | 2G9K | 0.81 | |
TC7 | 2,4,5-trichlorophenol | A | 2VCE | 0.76 | |
4NA | 1-CHLORO-6-(4-HYDROXYPHENYL)-2- NAPHTHOL | A,B | 1YY4 | 0.73 | |
BP3 | 2'-CHLORO-BIPHENYL-2,3-DIOL | A | 1LGT | 0.73 | |
3CH | 3-CHLOROPHENOL | A | 1LI3 | 0.76 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG2 | 0.7 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG1 | 0.7 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RH0 | 0.7 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGU | 0.7 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGT | 0.7 | |
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 | |
34C | (3-CHLORO-4-PROPOXY-PHENYL)-ACETIC ACID | A,B | 1HT8 | 0.71 | |
EPT | HEPTANYL-P-PHENOL | A,B | 1AHZ | 0.72 | |
BP6 | 2',6'-DICHLORO-BIPHENYL-2,6-DIOL | A | 1LKD | 0.75 | |
OTR | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGT | 0.7 | |
OTR | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG2 | 0.7 | |
OTR | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 2AN4 | 0.7 | |
STL | RESVERATROL | A,B | 3CKL | 0.71 | |
STL | RESVERATROL | A,B,C,D | 1U0W | 0.71 | |
STL | RESVERATROL | A | 1CGZ | 0.71 | |
STL | RESVERATROL | A,B,C,D,E,F, G,H,I,J,K,L, M,N | 2JIZ | 0.71 | |
STL | RESVERATROL | A | 1Z1F | 0.71 | |
STL | RESVERATROL | A | 1DVS | 0.71 | |
STL | RESVERATROL | A,B | 1SG0 | 0.71 | |
2LP | 2-ALLYLPHENOL | A | 1OV5 | 0.73 | |
269 | (1R)-3-chloro-1-phenylpropan-1- ol | A | 2RBS | 0.73 | |
43M | 4-CHLORO-3-METHYLPHENOL | A | 2P7A | 0.8 | |
LYL | 2-ALLYL-6-METHYL-PHENOL | A | 1OV7 | 0.71 | |
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 | |
CHB | 3-CHLORO-4-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCH | 0.78 | |
MCT | 4-METHYLCATECHOL | A | 1L4G | 0.7 | |
MCT | 4-METHYLCATECHOL | A | 2EHZ | 0.7 | |
MCT | 4-METHYLCATECHOL | A,B | 1DMH | 0.7 | |
DHR | (2S)-HYDROXY(4-HYDROXYPHENYL)ETHANENITRILE | A,B | 1E55 | 0.76 | |
2CH | 2-CHLOROPHENOL | A | 1WBO | 0.8 | |
ETY | 4-ethylphenol | A,B,C,D | 2RA6 | 0.73 | |
NE2 | 3,3',4',5-TETRACHLOROBIPHENYL-4- OL | A,B | 2GAB | 0.82 | |
PCR | P-CRESOL | A | 1JHV | 0.74 | |
PCR | P-CRESOL | A | 1JHU | 0.74 | |
PCR | P-CRESOL | A,B,C,D | 1DIQ | 0.74 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D | 3E5U | 0.8 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B | 3E6B | 0.8 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D | 3E5X | 0.8 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B | 2H6B | 0.8 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | C | 3E6C | 0.8 | |
FCR | ALPHA,ALPHA,ALPHA-TRIFLUORO-P-CRESOL | A,B | 1E0Y | 0.73 | |
FCR | ALPHA,ALPHA,ALPHA-TRIFLUORO-P-CRESOL | A,B | 1E8G | 0.73 | |
PCQ | 3,5,3',5'-TETRACHLORO-BIPHENYL- 4,4'-DIOL | A,B | 1G3M | 0.87 | |
PCQ | 3,5,3',5'-TETRACHLORO-BIPHENYL- 4,4'-DIOL | A,B | 2G5U | 0.87 | |
C2U | 3,5-dichloro-2-hydroxybenzoic acid | A | 3C3U | 0.76 | |
C2U | 3,5-dichloro-2-hydroxybenzoic acid | A | 3CV7 | 0.76 |