Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02289573
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 |
174 | 4-CHLORO-BENZOIC ACID | X | 3DLP | 0.72 | |
174 | 4-CHLORO-BENZOIC ACID | X | 1T5D | 0.72 | |
PCQ | 3,5,3',5'-TETRACHLORO-BIPHENYL- 4,4'-DIOL | A,B | 1G3M | 0.74 | |
PCQ | 3,5,3',5'-TETRACHLORO-BIPHENYL- 4,4'-DIOL | A,B | 2G5U | 0.74 | |
AC6 | P-HYDROXYACETOPHENONE | A | 2GQ8 | 0.75 | |
AC6 | P-HYDROXYACETOPHENONE | X | 2O48 | 0.75 | |
4NA | 1-CHLORO-6-(4-HYDROXYPHENYL)-2- NAPHTHOL | A,B | 1YY4 | 0.73 | |
HXS | 4-[(1R,2S)-1-ethyl-2-(4-hydroxyphenyl)butyl]phenol | A,B | 3CV6 | 0.71 | |
A15 | 3'-3"-DICHLOROPHENOL-1,8-3H-BENZO[DE]ISOCHROMEN- 1-ONE | A | 1TSL | 0.7 | |
3BZ | 3-chlorobenzoate | X | 2QVZ | 0.72 | |
3BZ | 3-chlorobenzoate | X | 2QVX | 0.72 | |
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 | |
BP3 | 2'-CHLORO-BIPHENYL-2,3-DIOL | A | 1LGT | 0.73 | |
CHB | 3-CHLORO-4-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCH | 0.76 | |
3CA | A,B | 2B77 | 0.77 | ||
NE2 | 3,3',4',5-TETRACHLOROBIPHENYL-4- OL | A,B | 2GAB | 0.78 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D | 3E5U | 0.78 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B | 3E6B | 0.78 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D | 3E5X | 0.78 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B | 2H6B | 0.78 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | C | 3E6C | 0.78 | |
BP6 | 2',6'-DICHLORO-BIPHENYL-2,6-DIOL | A | 1LKD | 0.73 | |
C2U | 3,5-dichloro-2-hydroxybenzoic acid | A | 3C3U | 0.72 | |
C2U | 3,5-dichloro-2-hydroxybenzoic acid | A | 3CV7 | 0.72 | |
2E3 | (2E)-3-[4-hydroxy-3-(3,5,5,8,8- pentamethyl-5,6,7,8-tetrahydronaphthalen- 2-yl)phenyl]prop-2-enoic acid | A | 3FUG | 0.71 | |
LJ1 | 2,6-dimethyl-4-[(E)-2-phenylethenyl]phenol | A,B | 3CN0 | 0.71 | |
34Z | 3,4-dichlorobenzoate | X | 2QVY | 0.76 | |
34Z | 3,4-dichlorobenzoate | X | 2QW0 | 0.76 | |
EQI | EQUILIN | A,B | 1EQU | 0.7 | |
HC4 | A | 1TS6 | 0.74 | ||
HC4 | A | 3PHY | 0.74 | ||
HC4 | A | 3PYP | 0.74 | ||
HC4 | A | 1T1C | 0.74 | ||
HC4 | A | 1OT6 | 0.74 | ||
HC4 | A | 1TS0 | 0.74 | ||
HC4 | A | 1T1A | 0.74 | ||
HC4 | A | 2PYP | 0.74 | ||
HC4 | A | 2ZOI | 0.74 | ||
HC4 | A | 1OTI | 0.74 | ||
HC4 | A | 1XFQ | 0.74 | ||
HC4 | A | 2D01 | 0.74 | ||
HC4 | A,B,C,D,E,F, G,H | 2O7B | 0.74 | ||
HC4 | A | 2ZOH | 0.74 | ||
HC4 | A | 1GSW | 0.74 | ||
HC4 | A | 2QJ7 | 0.74 | ||
HC4 | A | 1F9I | 0.74 | ||
HC4 | X | 1UWP | 0.74 | ||
HC4 | A | 2PHY | 0.74 | ||
HC4 | A | 1T1B | 0.74 | ||
HC4 | A | 1F98 | 0.74 | ||
HC4 | A | 1T19 | 0.74 | ||
HC4 | X | 1UWN | 0.74 | ||
HC4 | A,B,C,D,E,F, G,H | 2O7F | 0.74 | ||
HC4 | A | 1UGU | 0.74 | ||
HC4 | A | 1TS8 | 0.74 | ||
HC4 | A,B | 1OTD | 0.74 | ||
HC4 | A | 1OTE | 0.74 | ||
HC4 | A | 1GSX | 0.74 | ||
HC4 | A | 1TS7 | 0.74 | ||
HC4 | A | 2PYR | 0.74 | ||
HC4 | A | 1S4S | 0.74 | ||
HC4 | A | 1GSV | 0.74 | ||
HC4 | A | 2I9V | 0.74 | ||
HC4 | A | 2QWS | 0.74 | ||
HC4 | A | 1XFN | 0.74 | ||
HC4 | A | 1S4R | 0.74 | ||
HC4 | A | 1T18 | 0.74 | ||
HC4 | A | 1OTA | 0.74 | ||
HC4 | A | 1D7E | 0.74 | ||
HC4 | A | 1S1Z | 0.74 | ||
HC4 | A,B,C | 1MZU | 0.74 | ||
HC4 | A,B | 1ODV | 0.74 | ||
HC4 | A,B | 2J3J | 0.74 | ||
HC4 | A | 2QJ5 | 0.74 | ||
HC4 | A | 1OTB | 0.74 | ||
HC4 | A | 2D02 | 0.74 | ||
HC4 | A | 1OT9 | 0.74 | ||
HC4 | A | 1NWZ | 0.74 | ||
HC4 | A | 1S1Y | 0.74 | ||
43M | 4-CHLORO-3-METHYLPHENOL | A | 2P7A | 0.72 | |
HPP | HYDROXYPHENYL PROPIONIC ACID | A,B | 2TPL | 0.73 | |
HPP | HYDROXYPHENYL PROPIONIC ACID | A,B,C,D | 3GGP | 0.73 | |
DES | DIETHYLSTILBESTROL | A,B,C,D | 1S9P | 0.74 | |
DES | DIETHYLSTILBESTROL | A,B | 3ERD | 0.74 | |
DES | DIETHYLSTILBESTROL | A,B | 1TT6 | 0.74 | |
DES | DIETHYLSTILBESTROL | A,B,C,D | 1TZ8 | 0.74 | |
HCC | 2',4,4'-TRIHYDROXYCHALCONE | D | 1FP1 | 0.71 | |
AFI | 2-[4-(4-CHLOROPHENYL)CYCLOHEXYLIDENE]- 3,4-DIHYDROXY-1(2H)-NAPHTHALENONE | A,B | 1UUM | 0.76 | |
BPZ | 4,4'-cyclohexane-1,1-diyldiphenol | A | 2ZKC | 0.73 | |
HBA | P-HYDROXYBENZALDEHYDE | A | 1K03 | 0.71 | |
HBA | P-HYDROXYBENZALDEHYDE | A,B | 2VQ5 | 0.71 | |
HBA | P-HYDROXYBENZALDEHYDE | A,B | 1EB9 | 0.71 | |
HBA | P-HYDROXYBENZALDEHYDE | A | 2GQ9 | 0.71 | |
HBA | P-HYDROXYBENZALDEHYDE | A,B | 1Z42 | 0.71 | |
HBA | P-HYDROXYBENZALDEHYDE | A | 1OYB | 0.71 | |
FHC | 2-FLUORO-3-(4-HYDROXYPHENYL)-2E- PROPENEOATE | A | 2OPA | 0.72 | |
FHC | 2-FLUORO-3-(4-HYDROXYPHENYL)-2E- PROPENEOATE | A,B,C | 1MFI | 0.72 | |
FHC | 2-FLUORO-3-(4-HYDROXYPHENYL)-2E- PROPENEOATE | A,B | 1GYY | 0.72 | |
DBE | bis(4-hydroxyphenyl)methanone | A | 2VKU | 0.77 | |
ENO | 3-(4-HYDROXY-PHENYL)PYRUVIC ACID | H,I | 1A2C | 0.71 | |
ENO | 3-(4-HYDROXY-PHENYL)PYRUVIC ACID | A,B,C | 1CA7 | 0.71 | |
ENO | 3-(4-HYDROXY-PHENYL)PYRUVIC ACID | A,B,C,D | 3GGO | 0.71 | |
TOH | (3E)-4-(2-HYDROXYPHENYL)-2-OXOBUT- 3-ENOIC ACID | A | 2IME | 0.71 | |
TOH | (3E)-4-(2-HYDROXYPHENYL)-2-OXOBUT- 3-ENOIC ACID | A | 2IMD | 0.71 | |
NE1 | 2',3,3',4',5-PENTACHLOROBIPHENYL- 4-OL | A,B | 2G9K | 0.77 | |
2HC | (2E)-3-(2-HYDROXYPHENYL)ACRYLIC ACID | A,B | 1V5Z | 0.72 | |
IH5 | [4-(4-HYDROXY-3-ISOPROPYLPHENOXY)- 3,5-DIMETHYLPHENYL]ACETIC ACID | A | 1NAV | 0.7 | |
IH5 | [4-(4-HYDROXY-3-ISOPROPYLPHENOXY)- 3,5-DIMETHYLPHENYL]ACETIC ACID | A | 1NAX | 0.7 |