Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00540757
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 |
HPP | HYDROXYPHENYL PROPIONIC ACID | A,B | 2TPL | 0.72 | |
HPP | HYDROXYPHENYL PROPIONIC ACID | A,B,C,D | 3GGP | 0.72 | |
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 | 0.72 | |
AGI | 5,7-dihydroxy-2-(4-hydroxyphenyl)- 4H-chromen-4-one | A,B,C,D,E,F | 3CF9 | 0.71 | |
3HP | 3-HYDROXYPHENYLACETATE | M,N,O,P,Q,R | 3PCE | 0.71 | |
DFL | 2-(4-HYDROXY-PHENYL)-CHROMAN-4- ONE | A,B | 1JEP | 0.71 | |
4HP | 4-HYDROXYPHENYLACETATE | A,B,C,D | 2JBT | 0.72 | |
4HP | 4-HYDROXYPHENYLACETATE | A | 2YYJ | 0.72 | |
4HP | 4-HYDROXYPHENYLACETATE | A | 2YYM | 0.72 | |
4HP | 4-HYDROXYPHENYLACETATE | B | 1AI6 | 0.72 | |
4HP | 4-HYDROXYPHENYLACETATE | M,N,O,P,Q,R | 3PCG | 0.72 | |
FC3 | 5-[2-(TRIFLUOROMETHYL)PHENYL]-2- FUROIC ACID | A | 2EVC | 0.73 | |
IHB | 3-IODO-4-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCI | 0.73 | |
QSO | 5,7-dihydroxy-3-(4-methoxyphenyl)- 4H-chromen-4-one | A,B | 2QYO | 0.71 | |
T4A | C,D | 1KGI | 0.71 | ||
T4A | A,B | 1Z7J | 0.71 | ||
DFV | 7-HYDROXY-2-(4-HYDROXY-PHENYL)- CHROMAN-4-ONE | B,C | 1JX1 | 0.71 | |
DFV | 7-HYDROXY-2-(4-HYDROXY-PHENYL)- CHROMAN-4-ONE | A,B | 1JX0 | 0.71 | |
DFV | 7-HYDROXY-2-(4-HYDROXY-PHENYL)- CHROMAN-4-ONE | A,B | 1FM7 | 0.71 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | B | 2BV0 | 0.7 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | A,B,D,F,H,J,L | 1YKP | 0.7 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | A | 1N8Q | 0.7 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | A,B | 2BSL | 0.7 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | B,D,F,H,J,L | 1YKL | 0.7 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | B,D | 1B4U | 0.7 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | A | 3DX5 | 0.7 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCA | 0.7 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | B,D,F,H,J,L | 1YKN | 0.7 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | B | 1EOB | 0.7 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | A | 1PHH | 0.7 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | B | 2BUV | 0.7 | |
ORE | 4-(2,7-DIFLUORO-6-HYDROXY-3-OXO- 3H-XANTHEN-9-YL)ISOPHTHALIC ACID | H,I | 2A9N | 0.71 | |
TOM | 4-(2-METHOXYPHENYL)-2-OXOBUT-3- ENOIC ACID | A | 2IMF | 0.77 | |
8MR | (3R)-4,4-DIFLUORO-3-[(4-METHOXYPHENYL)SULFONYL]BUTANOIC ACID | A,B | 2OW2 | 0.76 | |
ENO | 3-(4-HYDROXY-PHENYL)PYRUVIC ACID | H,I | 1A2C | 0.73 | |
ENO | 3-(4-HYDROXY-PHENYL)PYRUVIC ACID | A,B,C | 1CA7 | 0.73 | |
ENO | 3-(4-HYDROXY-PHENYL)PYRUVIC ACID | A,B,C,D | 3GGO | 0.73 | |
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 | |
HMO | 4'-HYDROXY-7-METHOXYISOFLAVONE | A | 1FP2 | 0.71 | |
FHB | 3-FLUORO-4-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCF | 0.75 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 3GCL | 0.76 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 2QQT | 0.76 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 1TGM | 0.76 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 2G5J | 0.76 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 1OXR | 0.76 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 3HWY | 0.76 | |
296 | (3R)-3-amino-2,2-difluoro-3-(4- methoxyphenyl)propanoic acid | A,B | 2RJS | 0.71 | |
ANN | 4-METHOXYBENZOIC ACID | A | 2B96 | 0.83 | |
ANN | 4-METHOXYBENZOIC ACID | A | 2QUE | 0.83 | |
ANN | 4-METHOXYBENZOIC ACID | A | 1SV3 | 0.83 | |
ANN | 4-METHOXYBENZOIC ACID | A | 1O2E | 0.83 | |
ANN | 4-METHOXYBENZOIC ACID | A,B,C,D | 3CBI | 0.83 | |
DDC | 7-HYDROXY-2-PHENYL-CHROMAN-4-ONE | A,B | 1FM8 | 0.7 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,C,E | 1KYZ | 0.72 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 1JT2 | 0.72 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 6ATJ | 0.72 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,B | 1GKL | 0.72 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 1GWT | 0.72 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,B,C | 2BJH | 0.72 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 1GW2 | 0.72 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 3CBG | 0.72 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 2BNJ | 0.72 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,B | 1UWC | 0.72 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 7ATJ | 0.72 | |
1FL | 5-(2,4-DIFLUOROPHENYL)-2-HYDROXY- BENZOIC ACID | A,B | 2BXE | 0.71 | |
1FL | 5-(2,4-DIFLUOROPHENYL)-2-HYDROXY- BENZOIC ACID | A,B | 3D2T | 0.71 | |
MPB | 4-HYDROXY-BENZOIC ACID METHYL ESTER | B,C,D | 2VK0 | 0.79 | |
MPB | 4-HYDROXY-BENZOIC ACID METHYL ESTER | A,B,D | 3MTH | 0.79 | |
AZ2 | (2S)-2-ETHOXY-3-[4-(2-{4-[(METHYLSULFONYL)OXY]PHENYL}ETHOXY)PHENYL]PROPANOIC ACID | A,B | 1I7I | 0.71 | |
AZ2 | (2S)-2-ETHOXY-3-[4-(2-{4-[(METHYLSULFONYL)OXY]PHENYL}ETHOXY)PHENYL]PROPANOIC ACID | A | 1I7G | 0.71 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 2PIT | 0.73 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 1NQ1 | 0.73 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 2PIU | 0.73 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 2PKL | 0.73 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A,B | 3D57 | 0.73 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 1NQ2 | 0.73 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 2QPY | 0.73 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 1NQ0 | 0.73 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 1NUO | 0.73 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A,B | 2PIN | 0.73 | |
4FE | (2E)-3-(3-hydroxy-4-methoxyphenyl)prop- 2-enoic acid | A | 3CBG | 0.72 | |
VXX | VANILLATE | A,B | 1WB6 | 0.76 | |
3HB | 3-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCB | 0.71 | |
3HB | 3-HYDROXYBENZOIC ACID | A | 2DKH | 0.71 | |
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 | |
NAR | NARINGENIN | A,B | 2UXU | 0.7 | |
NAR | NARINGENIN | A | 2BRT | 0.7 | |
NAR | NARINGENIN | A | 1CGK | 0.7 | |
NAR | NARINGENIN | A,B | 1EYQ | 0.7 | |
A04 | 5-[2-(TRIFLUOROMETHOXY)PHENYL]- 2-FUROIC ACID | A | 2Q94 | 0.73 | |
FHC | 2-FLUORO-3-(4-HYDROXYPHENYL)-2E- PROPENEOATE | A | 2OPA | 0.7 | |
FHC | 2-FLUORO-3-(4-HYDROXYPHENYL)-2E- PROPENEOATE | A,B,C | 1MFI | 0.7 | |
FHC | 2-FLUORO-3-(4-HYDROXYPHENYL)-2E- PROPENEOATE | A,B | 1GYY | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CJ4 | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1DOB | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PXB | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A,B | 1G1B | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A,B | 1YKJ | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1IUV | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PBE | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCC | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PDH | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | B | 2BUW | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CC4 | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CC6 | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1IUW | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1FW9 | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1G81 | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1BGJ | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1IUX | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CJ3 | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1D7L | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 2PHH | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1BGN | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PXA | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1DOC | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1K0I | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1BKW | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1JD3 | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PXC | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1TT8 | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CJ2 | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A,B | 1Q4S | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1BF3 | 0.74 | |
PHB | P-HYDROXYBENZOIC ACID | B | 2BUR | 0.74 | |
AC6 | P-HYDROXYACETOPHENONE | A | 2GQ8 | 0.76 | |
AC6 | P-HYDROXYACETOPHENONE | X | 2O48 | 0.76 | |
34C | (3-CHLORO-4-PROPOXY-PHENYL)-ACETIC ACID | A,B | 1HT8 | 0.7 | |
GW6 | (6alpha,11alpha,14beta,16alpha,17alpha)- 6,9-difluoro-17-{[(fluoromethyl)sulfanyl]carbonyl}- 11-hydroxy-16-methyl-3-oxoandrosta- 1,4-dien-17-yl furan-2-carboxylate | A,B | 3CLD | 0.7 | |
AI7 | 3-(heptyloxy)benzoic acid | A,B | 2O3Z | 0.77 | |
VNL | 4-HYDROXY-3-METHOXYBENZOATE | A,B,C,D | 2AHC | 0.76 | |
VNL | 4-HYDROXY-3-METHOXYBENZOATE | A | 1XLR | 0.76 | |
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 | |
GRR | (2S)-2-(4-ethylphenoxy)-3-phenylpropanoic acid | A | 3CDS | 0.7 | |
NPS | (2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid | A | 2VDB | 0.72 | |
DBE | bis(4-hydroxyphenyl)methanone | A | 2VKU | 0.74 | |
B21 | 5-(2-METHOXYPHENYL)-2-FUROIC ACID | A | 2Q93 | 0.71 | |
MPP | 3-(3,4-DIMETHOXYPHENYL)PROPIONIC ACID | A,B | 2AY3 | 0.76 | |
V55 | 4-hydroxy-3-methoxybenzaldehyde | B,D,E,F | 2VSS | 0.74 | |
V55 | 4-hydroxy-3-methoxybenzaldehyde | A,B,D,E,F | 2VSU | 0.74 | |
DOB | 2,4-DIHYDROXYBENZOIC ACID | A | 1DOD | 0.71 | |
DOB | 2,4-DIHYDROXYBENZOIC ACID | A | 1DOE | 0.71 | |
DOB | 2,4-DIHYDROXYBENZOIC ACID | A | 1PBB | 0.71 | |
FLU | 2-(6-HYDROXY-3-OXO-3H-XANTHEN-9- YL)-BENZOIC ACID | L | 1FLR | 0.7 | |
FLU | 2-(6-HYDROXY-3-OXO-3H-XANTHEN-9- YL)-BENZOIC ACID | A,B | 1N0S | 0.7 | |
FLU | 2-(6-HYDROXY-3-OXO-3H-XANTHEN-9- YL)-BENZOIC ACID | C,L | 1T66 | 0.7 | |
FLU | 2-(6-HYDROXY-3-OXO-3H-XANTHEN-9- YL)-BENZOIC ACID | A | 1X9Q | 0.7 | |
FLU | 2-(6-HYDROXY-3-OXO-3H-XANTHEN-9- YL)-BENZOIC ACID | A,D | 2NMV | 0.7 | |
SYR | SYRINGATE | A,B | 1WB5 | 0.73 | |
FLN | 2-PHENYL-4H-CHROMEN-4-ONE | A | 2G0L | 0.71 |