Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02999248
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 |
FLN | 2-PHENYL-4H-CHROMEN-4-ONE | A | 2G0L | 0.84 | |
23A | 2,3-DIHYDROXYBENZALDEHYDE | A,B,C,D | 2DVX | 0.74 | |
PSN | BENZYL 2-FORMYLPHENYL HYDROGEN PHOSPHATE | A | 1O4K | 0.77 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 3GCL | 0.83 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 2QQT | 0.83 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 1TGM | 0.83 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 2G5J | 0.83 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 1OXR | 0.83 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 3HWY | 0.83 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 2I2Z | 0.72 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B,C | 1FIQ | 0.72 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 2I30 | 0.72 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 1PTH | 0.72 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 3DEU | 0.72 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B,C,D | 2E1Q | 0.72 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 3HGX | 0.72 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 3BPX | 0.72 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 1WYG | 0.72 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 1JGS | 0.72 | |
SAL | 2-HYDROXYBENZOIC ACID | X | 1M6E | 0.72 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 3B9M | 0.72 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 1FO4 | 0.72 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 1Y7I | 0.72 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 2FN1 | 0.72 | |
V55 | 4-hydroxy-3-methoxybenzaldehyde | B,D,E,F | 2VSS | 0.76 | |
V55 | 4-hydroxy-3-methoxybenzaldehyde | A,B,D,E,F | 2VSU | 0.76 | |
4BR | 2-(4-METHYLPHENOXY)ETHYLPHOSPHINATE | A | 1PE7 | 0.72 | |
U01 | 3-[1-(4-BROMO-PHENYL)-2-METHYL- PROPYL]-4-HYDROXY-CHROMEN-2-ONE | A | 1UPJ | 0.72 | |
BZF | BENZOFURAN | A | 182L | 0.79 | |
YZ9 | 7-HYDROXY-2-OXO-CHROMENE-3-CARBOXYLIC ACID ETHYL ESTER | A,B,C | 1GCZ | 0.71 | |
ZHZ | 2-(4-METHOXYPHENYL)ACETAMIDE | D,H | 2HKR | 0.72 | |
B21 | 5-(2-METHOXYPHENYL)-2-FUROIC ACID | A | 2Q93 | 0.73 | |
DBA | (2,6-DIMETHYL-PHENOXY)-ACETIC ACID | A,B | 1IDB | 0.71 | |
34C | (3-CHLORO-4-PROPOXY-PHENYL)-ACETIC ACID | A,B | 1HT8 | 0.71 | |
BZM | BENZOIC ACID PHENYLMETHYLESTER | A,B | 1DZM | 0.72 | |
L41 | {4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]phenoxy}acetic acid | A,B | 3D5F | 0.7 | |
2HI | (2S,3R)-2,7-DIHYDROXY-3-(4-HYDROXYPHENYL)- 2,3-DIHYDRO-4H-CHROMEN-4-ONE | A | 1ZG3 | 0.71 | |
GRR | (2S)-2-(4-ethylphenoxy)-3-phenylpropanoic acid | A | 3CDS | 0.71 | |
HBA | P-HYDROXYBENZALDEHYDE | A | 1K03 | 0.73 | |
HBA | P-HYDROXYBENZALDEHYDE | A,B | 2VQ5 | 0.73 | |
HBA | P-HYDROXYBENZALDEHYDE | A,B | 1EB9 | 0.73 | |
HBA | P-HYDROXYBENZALDEHYDE | A | 2GQ9 | 0.73 | |
HBA | P-HYDROXYBENZALDEHYDE | A,B | 1Z42 | 0.73 | |
HBA | P-HYDROXYBENZALDEHYDE | A | 1OYB | 0.73 | |
ANN | 4-METHOXYBENZOIC ACID | A | 2B96 | 0.77 | |
ANN | 4-METHOXYBENZOIC ACID | A | 2QUE | 0.77 | |
ANN | 4-METHOXYBENZOIC ACID | A | 1SV3 | 0.77 | |
ANN | 4-METHOXYBENZOIC ACID | A | 1O2E | 0.77 | |
ANN | 4-METHOXYBENZOIC ACID | A,B,C,D | 3CBI | 0.77 | |
DTC | BISHYDROXY[2H-1-BENZOPYRAN-2-ONE,1,2- BENZOPYRONE] | A | 2Z9C | 0.75 | |
DTC | BISHYDROXY[2H-1-BENZOPYRAN-2-ONE,1,2- BENZOPYRONE] | A,B | 1OOQ | 0.75 | |
DTC | BISHYDROXY[2H-1-BENZOPYRAN-2-ONE,1,2- BENZOPYRONE] | A,B,C,D,E,F, G,H | 2F1O | 0.75 | |
300 | 2-FORMYL-6-METHOXYPHENYL DIHYDROGEN PHOSPHATE | A | 1O41 | 0.81 | |
BHF | 2-PHENYL-4H-BENZO[H]CHROMEN-4-ONE | A | 2HI4 | 0.74 | |
R71 | [4-({6-[ALLYL(METHYL)AMINO]HEXYL}OXY)- 2-FLUOROPHENYL](4-BROMOPHENYL)METHANONE | A | 1W6J | 0.72 | |
R71 | [4-({6-[ALLYL(METHYL)AMINO]HEXYL}OXY)- 2-FLUOROPHENYL](4-BROMOPHENYL)METHANONE | A,B,C | 1GSZ | 0.72 | |
AI7 | 3-(heptyloxy)benzoic acid | A,B | 2O3Z | 0.81 | |
MPB | 4-HYDROXY-BENZOIC ACID METHYL ESTER | B,C,D | 2VK0 | 0.73 | |
MPB | 4-HYDROXY-BENZOIC ACID METHYL ESTER | A,B,D | 3MTH | 0.73 | |
TOM | 4-(2-METHOXYPHENYL)-2-OXOBUT-3- ENOIC ACID | A | 2IMF | 0.74 | |
219 | CYCLOHEXYLMETHYL 2-FORMYLPHENYL HYDROGEN PHOSPHATE | A | 1O4I | 0.77 | |
KMP | 3,5,7-TRIHYDROXY-2-(4-HYDROXYPHENYL)- 4H-CHROMEN-4-ONE | A,B,C,D | 1H1M | 0.72 | |
KMP | 3,5,7-TRIHYDROXY-2-(4-HYDROXYPHENYL)- 4H-CHROMEN-4-ONE | A | 2C1Z | 0.72 | |
4HC | 4-HYDROXY-2H-CHROMEN-2-ONE | A,B | 1V5Y | 0.7 | |
COU | COUMARIN | A | 3CRB | 0.74 | |
COU | COUMARIN | A | 2PMJ | 0.74 | |
COU | COUMARIN | A | 2H90 | 0.74 | |
COU | COUMARIN | A,B,C,D | 1Z10 | 0.74 | |
COU | COUMARIN | A | 2PWB | 0.74 | |
QSO | 5,7-dihydroxy-3-(4-methoxyphenyl)- 4H-chromen-4-one | A,B | 2QYO | 0.72 | |
SAK | (2S)-5-hydroxy-2-(4-hydroxyphenyl)- 7-methoxy-2,3-dihydro-4H-chromen- 4-one | A,B,C,D,E,F | 3D04 | 0.74 | |
DFL | 2-(4-HYDROXY-PHENYL)-CHROMAN-4- ONE | A,B | 1JEP | 0.78 | |
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 | 0.73 | |
FRR | (3R,5Z,8S,9S,11E)-8,9,16-TRIHYDROXY- 14-METHOXY-3-METHYL-3,4,9,10-TETRAHYDRO- 1H-2-BENZOXACYCLOTETRADECINE-1,7(8H)- DIONE | A | 2E14 | 0.71 | |
299 | 2,6-DIFORMYL-4-METHYLPHENYL DIHYDROGEN PHOSPHATE | A | 1O4E | 0.75 | |
2PB | 2-[(DIOXIDOPHOSPHINO)OXY]BENZOATE | A | 1SDE | 0.71 | |
VII | 2,5-DIPHENYLFURAN-3,4-DICARBOXYLIC ACID | A,B | 2GFK | 0.71 | |
262 | 2-FORMYLPHENYL DIHYDROGEN PHOSPHATE | A | 1O4D | 0.77 | |
AC6 | P-HYDROXYACETOPHENONE | A | 2GQ8 | 0.71 | |
AC6 | P-HYDROXYACETOPHENONE | X | 2O48 | 0.71 | |
3MB | 3-METHOXYBENZAMIDE | A | 3PAX | 0.74 | |
DDC | 7-HYDROXY-2-PHENYL-CHROMAN-4-ONE | A,B | 1FM8 | 0.75 | |
DFV | 7-HYDROXY-2-(4-HYDROXY-PHENYL)- CHROMAN-4-ONE | B,C | 1JX1 | 0.74 | |
DFV | 7-HYDROXY-2-(4-HYDROXY-PHENYL)- CHROMAN-4-ONE | A,B | 1JX0 | 0.74 | |
DFV | 7-HYDROXY-2-(4-HYDROXY-PHENYL)- CHROMAN-4-ONE | A,B | 1FM7 | 0.74 | |
NAR | NARINGENIN | A,B | 2UXU | 0.74 | |
NAR | NARINGENIN | A | 2BRT | 0.74 | |
NAR | NARINGENIN | A | 1CGK | 0.74 | |
NAR | NARINGENIN | A,B | 1EYQ | 0.74 | |
FL8 | 6,4'-DIHYDROXY-3-METHYL-3',5'-DIBROMOFLAVONE | B,C | 1KGJ | 0.73 | |
GEN | GENISTEIN | A | 1QKM | 0.72 | |
GEN | GENISTEIN | A,B | 1X7J | 0.72 | |
GEN | GENISTEIN | A,B | 2QA8 | 0.72 | |
GEN | GENISTEIN | A | 1X7R | 0.72 | |
R88 | (4-BROMOPHENYL)[4-({(2E)-4-[CYCLOPROPYL(METHYL)AMINO]BUT- 2-ENYL}OXY)PHENYL]METHANONE | A,B,C | 1H36 | 0.72 | |
AGI | 5,7-dihydroxy-2-(4-hydroxyphenyl)- 4H-chromen-4-one | A,B,C,D,E,F | 3CF9 | 0.73 | |
HMO | 4'-HYDROXY-7-METHOXYISOFLAVONE | A | 1FP2 | 0.72 | |
DBF | DIBENZOFURAN-4,6-DICARBOXYLIC ACID | B | 1DVU | 0.7 | |
MPP | 3-(3,4-DIMETHOXYPHENYL)PROPIONIC ACID | A,B | 2AY3 | 0.71 | |
ZZ1 | 4-METHYL-2H-CHROMEN-2-ONE | A | 2CIP | 0.75 | |
SB8 | 2-(3-BENZOYLPHENOXY)ETHYL(HYDROXY)FORMAMIDE | A | 2AIA | 0.72 |