Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02468298
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 |
K55 | (2S)-2-{4-butoxy-3-[({[2-fluoro- 4-(trifluoromethyl)phenyl]carbonyl}amino)methyl]benzyl}butanoic acid | A,B | 2ZNP | 0.72 | |
DFL | 2-(4-HYDROXY-PHENYL)-CHROMAN-4- ONE | A,B | 1JEP | 0.71 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 2I2Z | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B,C | 1FIQ | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 2I30 | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 1PTH | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 3DEU | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B,C,D | 2E1Q | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 3HGX | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 3BPX | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 1WYG | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 1JGS | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | X | 1M6E | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 3B9M | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 1FO4 | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 1Y7I | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 2FN1 | 0.7 | |
ANN | 4-METHOXYBENZOIC ACID | A | 2B96 | 0.75 | |
ANN | 4-METHOXYBENZOIC ACID | A | 2QUE | 0.75 | |
ANN | 4-METHOXYBENZOIC ACID | A | 1SV3 | 0.75 | |
ANN | 4-METHOXYBENZOIC ACID | A | 1O2E | 0.75 | |
ANN | 4-METHOXYBENZOIC ACID | A,B,C,D | 3CBI | 0.75 | |
PSN | BENZYL 2-FORMYLPHENYL HYDROGEN PHOSPHATE | A | 1O4K | 0.7 | |
TOM | 4-(2-METHOXYPHENYL)-2-OXOBUT-3- ENOIC ACID | A | 2IMF | 0.72 | |
TMS | N-PROPYL-4-[(E)-2-(3,4,5-TRIMETHOXY- PHENYL)-VINYL]-BENZAMIDE | A,B | 1X6W | 0.71 | |
C39 | N-[(2S,4S,5S,7R)-4-AMINO-8-(BUTYLAMINO)- 5-HYDROXY-7-METHYL-2-(1-METHYLETHYL)- 8-OXOOCTYL]-2-(3-METHOXYPROPOXY)BENZAMIDE | C,O | 2V12 | 0.73 | |
SCL | ACETIC ACID SALICYLOYL-AMINO-ESTER | A | 1EBV | 0.87 | |
BVL | (2E)-1-[2-hydroxy-4-methoxy-5-(3- methylbut-2-en-1-yl)phenyl]-3-(4- hydroxyphenyl)prop-2-en-1-one | A | 2ZBH | 0.71 | |
BGF | 2,5-BIS(4-GUANYLPHENYL)FURAN | A | 227D | 0.7 | |
262 | 2-FORMYLPHENYL DIHYDROGEN PHOSPHATE | A | 1O4D | 0.71 | |
300 | 2-FORMYL-6-METHOXYPHENYL DIHYDROGEN PHOSPHATE | A | 1O41 | 0.74 | |
C40 | N-[(2R,4S,5S,7R)-4-AMINO-8-(BUTYLAMINO)- 5-HYDROXY-2,7-DIMETHYL-8-OXOOCTYL]- 2-(3-METHOXYPROPOXY)BENZAMIDE | A | 2V13 | 0.74 | |
PZM | 1-(4-METHOXYPHENYL)METHANAMINE | A,D,H | 2HJB | 0.75 | |
HV7 | 1-METHYLAMINE-2-HYDROXY-4-METHOXY- BENZENE | C | 1A8G | 0.73 | |
BZF | BENZOFURAN | A | 182L | 0.7 | |
2TN | 2-(4-(2-HYDROXY-3-(ISOPROPYLAMINO)PROPOXY)PHENYL)ETHANAMIDE | A | 2OTF | 0.71 | |
2TN | 2-(4-(2-HYDROXY-3-(ISOPROPYLAMINO)PROPOXY)PHENYL)ETHANAMIDE | A | 2NUV | 0.71 | |
2TN | 2-(4-(2-HYDROXY-3-(ISOPROPYLAMINO)PROPOXY)PHENYL)ETHANAMIDE | A | 2OUB | 0.71 | |
NBF | [(2-ETHOXY-1-NAPHTHOYL)AMINO]METHYLBORONIC ACID | A | 1NY0 | 0.78 | |
NBF | [(2-ETHOXY-1-NAPHTHOYL)AMINO]METHYLBORONIC ACID | A,B | 1YMS | 0.78 | |
F6F | 2-{[4-(TRIFLUOROMETHOXY)BENZOYL]AMINO}ETHYL DIHYDROGEN PHOSPHATE | A,B | 2CLM | 0.73 | |
F6F | 2-{[4-(TRIFLUOROMETHOXY)BENZOYL]AMINO}ETHYL DIHYDROGEN PHOSPHATE | A,B | 2CLF | 0.73 | |
F6F | 2-{[4-(TRIFLUOROMETHOXY)BENZOYL]AMINO}ETHYL DIHYDROGEN PHOSPHATE | A,B | 2CLE | 0.73 | |
MPB | 4-HYDROXY-BENZOIC ACID METHYL ESTER | B,C,D | 2VK0 | 0.71 | |
MPB | 4-HYDROXY-BENZOIC ACID METHYL ESTER | A,B,D | 3MTH | 0.71 | |
HTA | N-[3-(N'-HYDROXYCARBOXAMIDO)-2- (2-METHYLPROPYL)-PROPANOYL]-O-TYROSINE- N-METHYLAMIDE | A | 1FBL | 0.72 | |
AI7 | 3-(heptyloxy)benzoic acid | A,B | 2O3Z | 0.73 | |
296 | (3R)-3-amino-2,2-difluoro-3-(4- methoxyphenyl)propanoic acid | A,B | 2RJS | 0.75 | |
ZHH | 2-(4-METHOXYPHENYL)ETHANAMINE | D,H | 2HKR | 0.72 | |
JT6 | 3-[(4'-cyanobiphenyl-4-yl)oxy]- N-hydroxypropanamide | A | 2JT6 | 0.71 | |
MTJ | N,O-DIMETHYL-L-TYROSINE | A,B | 1ATL | 0.71 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 3GCL | 0.77 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 2QQT | 0.77 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 1TGM | 0.77 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 2G5J | 0.77 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 1OXR | 0.77 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 3HWY | 0.77 | |
SGI | 3-(4-hydroxyphenyl)propanamide | A,B | 2R9K | 0.72 | |
BEK | 2,3,5,6-TETRAFLUORO-4-METHOXY-BENZAMIDE | A | 1KJR | 0.77 | |
4MP | 1-(4-METHOXYBENZOYL)-2-PYRROLIDINONE | A,B | 2AL5 | 0.77 | |
401 | (2S)-2-{3-[({[2-fluoro-4-(trifluoromethyl)phenyl]carbonyl}amino)methyl]- 4-methoxybenzyl}butanoic acid | A,B | 2ZNQ | 0.74 | |
BJH | 1(R)-1-ACETAMIDO-2-(3-CARBOXY-2- HYDROXYPHENYL)ETHYL BORONIC ACID | A | 1ERQ | 0.71 | |
3MB | 3-METHOXYBENZAMIDE | A | 3PAX | 0.89 | |
HBD | 4-HYDROXYBENZAMIDE | B,C,D | 1BEN | 0.77 | |
ZHZ | 2-(4-METHOXYPHENYL)ACETAMIDE | D,H | 2HKR | 0.83 | |
SHA | SALICYLHYDROXAMIC ACID | X | 1V0H | 0.87 | |
SHA | SALICYLHYDROXAMIC ACID | A | 2QPK | 0.87 | |
SHA | SALICYLHYDROXAMIC ACID | A | 3FNL | 0.87 | |
SHA | SALICYLHYDROXAMIC ACID | A | 3GCJ | 0.87 | |
SHA | SALICYLHYDROXAMIC ACID | A | 1CK6 | 0.87 | |
FLN | 2-PHENYL-4H-CHROMEN-4-ONE | A | 2G0L | 0.76 | |
SB8 | 2-(3-BENZOYLPHENOXY)ETHYL(HYDROXY)FORMAMIDE | A | 2AIA | 0.72 | |
DB1 | 2,3-DIHYDROXYBENZAMIDE | A,B,C | 1X71 | 0.79 |