Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02412064
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 |
BP6 | 2',6'-DICHLORO-BIPHENYL-2,6-DIOL | A | 1LKD | 0.72 | |
BP3 | 2'-CHLORO-BIPHENYL-2,3-DIOL | A | 1LGT | 0.73 | |
TTB | 4-[(1E)-2-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRONAPHTHALEN-2- YL)PROP-1-ENYL]BENZOIC ACID | A | 1XAP | 0.74 | |
3CA | A,B | 2B77 | 0.75 | ||
UIN | 5,6,7,8,9,10-HEXAHYDRO-4-HYDROXY- 3-(1-PHENYLPROPYL)CYCLOOCTA[B]PYRAN- 2-ONE | B | 5UPJ | 0.7 | |
564 | 6-(5,5,8,8-TETRAMETHYL-5,6,7,8- TETRAHYDRO-NAPHTALENE-2-CARBONYL)- NAPHTALENE-2-CARBOXYLIC ACID | A | 1FCY | 0.74 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D | 3E5U | 0.73 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B | 3E6B | 0.73 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D | 3E5X | 0.73 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B | 2H6B | 0.73 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | C | 3E6C | 0.73 | |
APG | ATROLACTIC ACID (2-PHENYL-LACTIC ACID) | A | 1MRA | 0.72 | |
APG | ATROLACTIC ACID (2-PHENYL-LACTIC ACID) | A | 1MNS | 0.72 | |
APG | ATROLACTIC ACID (2-PHENYL-LACTIC ACID) | A | 1DTN | 0.72 | |
APG | ATROLACTIC ACID (2-PHENYL-LACTIC ACID) | A | 1MDR | 0.72 | |
DFA | DIPHENYLACETIC ACID | A,B,C | 1GMY | 0.71 | |
4NA | 1-CHLORO-6-(4-HYDROXYPHENYL)-2- NAPHTHOL | A,B | 1YY4 | 0.72 | |
156 | 4-[3-OXO-3-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTHALEN-2- YL)-PROPENYL]-BENZOIC ACID | A | 1FCZ | 0.75 | |
2CL | (2,6-DICHLOROPHENYL)ACETIC ACID | A | 2IPW | 0.74 | |
2CL | (2,6-DICHLOROPHENYL)ACETIC ACID | A | 2IS7 | 0.74 | |
AFI | 2-[4-(4-CHLOROPHENYL)CYCLOHEXYLIDENE]- 3,4-DIHYDROXY-1(2H)-NAPHTHALENONE | A,B | 1UUM | 0.84 | |
FE3 | 4-(2-aminoethyl)-3-chlorobenzoic acid | A,B | 2K1Q | 0.72 | |
184 | 6-[HYDROXY-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTALEN-2- YL)-METHYL]-NAPHTALENE-2-CARBOXYLIC ACID | A | 1FCX | 0.71 | |
34Z | 3,4-dichlorobenzoate | X | 2QVY | 0.73 | |
34Z | 3,4-dichlorobenzoate | X | 2QW0 | 0.73 | |
NIU | 6,7,8,9-TETRAHYDRO-4-HYDROXY-3- (1-PHENYLPROPYL)CYCLOHEPTA[B]PYRAN- 2-ONE | A | 6UPJ | 0.7 | |
FBC | A,B | 2B9A | 0.72 | ||
3BZ | 3-chlorobenzoate | X | 2QVZ | 0.76 | |
3BZ | 3-chlorobenzoate | X | 2QVX | 0.76 | |
NDD | 2,6-DICARBOXYNAPHTHALENE | A | 1U4O | 0.72 | |
NDD | 2,6-DICARBOXYNAPHTHALENE | A,B,C,D | 1HAC | 0.72 | |
BPZ | 4,4'-cyclohexane-1,1-diyldiphenol | A | 2ZKC | 0.71 | |
OSB | 2-SUCCINYLBENZOATE | A | 1FHV | 0.72 | |
OSB | 2-SUCCINYLBENZOATE | A,B,C,D | 1SJB | 0.72 | |
OSB | 2-SUCCINYLBENZOATE | A,B | 2QVH | 0.72 | |
174 | 4-CHLORO-BENZOIC ACID | X | 3DLP | 0.76 | |
174 | 4-CHLORO-BENZOIC ACID | X | 1T5D | 0.76 | |
OX1 | H,Y | 1LO2 | 0.72 | ||
HSI | (3R)-3-{4-[(4-CHLOROPHENYL)ETHYNYL]BENZOYL}NONANOIC ACID | A | 2Z2D | 0.74 | |
4FC | A | 1YSG | 0.73 | ||
973 | (5Z)-3-(4-CHLOROPHENYL)-4-HYDROXY- 5-(1-NAPHTHYLMETHYLENE)FURAN-2(5H)- ONE | A | 2Q85 | 0.77 | |
EQU | EQUILENIN | A,B | 1OGX | 0.71 | |
EQU | EQUILENIN | A,B,C,D,E,F | 1QJG | 0.71 | |
EQU | EQUILENIN | A,B | 1OH0 | 0.71 | |
EQU | EQUILENIN | A | 1W6Y | 0.71 | |
EQU | EQUILENIN | A,B | 1CQS | 0.71 | |
EQU | EQUILENIN | A | 1OGZ | 0.71 | |
EQU | EQUILENIN | A | 1GS3 | 0.71 | |
EQU | EQUILENIN | A | 1OHO | 0.71 | |
DBE | bis(4-hydroxyphenyl)methanone | A | 2VKU | 0.73 | |
PCQ | 3,5,3',5'-TETRACHLORO-BIPHENYL- 4,4'-DIOL | A,B | 1G3M | 0.71 | |
PCQ | 3,5,3',5'-TETRACHLORO-BIPHENYL- 4,4'-DIOL | A,B | 2G5U | 0.71 | |
26C | A,B | 2F7I | 0.72 |