Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02390457
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 |
ANQ | ACENAPHTHENEQUINONE | H,J | 1OAX | 0.71 | |
HE7 | 4-{[(14beta,17alpha)-3-hydroxyestra- 1,3,5(10)-trien-17-yl]oxy}-4-oxobutanoic acid | A,B,C,D | 2Z77 | 0.72 | |
NDD | 2,6-DICARBOXYNAPHTHALENE | A | 1U4O | 0.76 | |
NDD | 2,6-DICARBOXYNAPHTHALENE | A,B,C,D | 1HAC | 0.76 | |
173 | BENZOYL-FORMIC ACID | A,B | 1SZE | 0.73 | |
254 | 6-[HYDROXYIMINO-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTALEN-2- YL)-METHYL]-NAPHTALENE-2-CARBOXYLIC ACID | A | 1FD0 | 0.7 | |
564 | 6-(5,5,8,8-TETRAMETHYL-5,6,7,8- TETRAHYDRO-NAPHTALENE-2-CARBONYL)- NAPHTALENE-2-CARBOXYLIC ACID | A | 1FCY | 0.78 | |
HSI | (3R)-3-{4-[(4-CHLOROPHENYL)ETHYNYL]BENZOYL}NONANOIC ACID | A | 2Z2D | 0.71 | |
VII | 2,5-DIPHENYLFURAN-3,4-DICARBOXYLIC ACID | A,B | 2GFK | 0.7 | |
184 | 6-[HYDROXY-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTALEN-2- YL)-METHYL]-NAPHTALENE-2-CARBOXYLIC ACID | A | 1FCX | 0.75 | |
TRZ | TRAZEOLIDE | A | 1C12 | 0.82 | |
BM6 | 4-[2-(5,5,8,8-TETRAMETHYL-5,6,7,8- TETRAHYDRO-NAPHTHALEN-2-YL)-[1,3]DIOXOLAN- 2-YL]-BENZOIC ACID | A | 1MVC | 0.72 | |
BM6 | 4-[2-(5,5,8,8-TETRAMETHYL-5,6,7,8- TETRAHYDRO-NAPHTHALEN-2-YL)-[1,3]DIOXOLAN- 2-YL]-BENZOIC ACID | A,C,E,G | 1MZN | 0.72 | |
BNA | BIS-(NAPHTHYL-1-METHYL) ACETIC ACID | I | 4ER1 | 0.73 | |
BNA | BIS-(NAPHTHYL-1-METHYL) ACETIC ACID | A | 1FQ5 | 0.73 | |
791 | 2-PHENYLMALONIC ACID | A | 1O4P | 0.74 | |
OAL | (1,8-DIHYDROXY-9,10-DIOXO-9,10- DIHYDRO-ANTHRACEN-2-YL)-ACETIC ACID | B | 1N5T | 0.77 | |
9TA | 1,4-BIS-[2-(2-HYDROXY-ETHYLAMINO)- ETHYLAMINO]-ANTHRAQUINONE | A,B | 1FDG | 0.73 | |
OSB | 2-SUCCINYLBENZOATE | A | 1FHV | 0.78 | |
OSB | 2-SUCCINYLBENZOATE | A,B,C,D | 1SJB | 0.78 | |
OSB | 2-SUCCINYLBENZOATE | A,B | 2QVH | 0.78 | |
OX1 | H,Y | 1LO2 | 0.74 | ||
DFA | DIPHENYLACETIC ACID | A,B,C | 1GMY | 0.74 | |
NLA | NAPHTHALEN-1-YL-ACETIC ACID | A,B,C,D | 1LRH | 0.75 | |
NLA | NAPHTHALEN-1-YL-ACETIC ACID | B | 2P1O | 0.75 | |
BIK | 3,7-DIHYDROXY-2-NAPHTHOIC ACID | A | 1U5A | 0.7 | |
BIK | 3,7-DIHYDROXY-2-NAPHTHOIC ACID | A | 1U5C | 0.7 | |
PMA | PYROMELLITIC ACID | A,B | 1FUP | 0.71 | |
FLP | FLURBIPROFEN | A,B,C,D | 3PGH | 0.71 | |
FLP | FLURBIPROFEN | A,B | 1CQE | 0.71 | |
FLP | FLURBIPROFEN | A,B | 1EQH | 0.71 | |
FLP | FLURBIPROFEN | A,B | 2AYL | 0.71 | |
FLP | FLURBIPROFEN | A | 1DVT | 0.71 | |
FLP | FLURBIPROFEN | A | 1R9O | 0.71 | |
MUF | (8alpha,10alpha,13alpha,17beta)- 17-[(4-hydroxyphenyl)carbonyl]androsta- 3,5-diene-3-carboxylic acid | A,B | 3BEJ | 0.74 | |
E04 | 3-CARBOXAMIDO-1,3,5(10)-ESTRATRIEN- 17(R)-SPIRO-2'(5',5'-DIMETHYL-6'OXO)TETRAHYDROPYRAN | A | 1ZQ5 | 0.7 | |
FBC | A,B | 2B9A | 0.72 | ||
AFI | 2-[4-(4-CHLOROPHENYL)CYCLOHEXYLIDENE]- 3,4-DIHYDROXY-1(2H)-NAPHTHALENONE | A,B | 1UUM | 0.73 | |
156 | 4-[3-OXO-3-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTHALEN-2- YL)-PROPENYL]-BENZOIC ACID | A | 1FCZ | 0.81 | |
AN1 | 3-(10-METHYL-ANTHRACEN-9-YL)-PROPIONIC ACID | H,Y | 1LO3 | 0.72 | |
BFL | A,B | 1Q4G | 0.73 | ||
PIC | 6-(DIFLUORO-PHOSPHONO-METHYL)-NAPHTHALENE- 2-CARBOXYLIC ACID | A | 1BZJ | 0.7 | |
PHT | PHTHALIC ACID | A,B,C | 2B7P | 0.74 | |
PHT | PHTHALIC ACID | A | 3C2V | 0.74 | |
PHT | PHTHALIC ACID | A,B,C,D,E,F | 1QPR | 0.74 | |
PHT | PHTHALIC ACID | A,B | 3C2R | 0.74 | |
ELI | 6-(3-METHYL-1,4-DIOXO-1,4-DIHYDRONAPHTHALEN- 2-YL)HEXANOIC ACID | A,B | 2GH5 | 0.78 | |
ADL | (1,8-DIHYDROXY-9-OXO-9,10-DIHYDRO- ANTHRACEN-2-YL)-ACETIC ACID | A,B | 1N5S | 0.76 | |
GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1K5S | 0.71 | |
GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1KEC | 0.71 | |
GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1K7D | 0.71 | |
TTB | 4-[(1E)-2-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRONAPHTHALEN-2- YL)PROP-1-ENYL]BENZOIC ACID | A | 1XAP | 0.79 | |
4FC | A | 1YSG | 0.73 | ||
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 | |
BZS | L-BENZYLSUCCINIC ACID | A | 1CBX | 0.72 | |
BZS | L-BENZYLSUCCINIC ACID | A | 1HYT | 0.72 | |
BZS | L-BENZYLSUCCINIC ACID | A,B | 1WHT | 0.72 | |
26C | A,B | 2F7I | 0.72 | ||
CIN | 4-CARBOXYCINNAMIC ACID | A,B,C,D | 1HAB | 0.7 | |
CIN | 4-CARBOXYCINNAMIC ACID | A,B | 1T6J | 0.7 |