Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03959255
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 |
DHC![]() | CAFFEIC ACID | A,B,C,D,E,F, G,H | 2O7D | 0.72 | ![]() |
DHC![]() | CAFFEIC ACID | A | 1KOU | 0.72 | ![]() |
HC4![]() | A | 1TS6 | 0.77 | ![]() | |
HC4![]() | A | 3PHY | 0.77 | ![]() | |
HC4![]() | A | 3PYP | 0.77 | ![]() | |
HC4![]() | A | 1T1C | 0.77 | ![]() | |
HC4![]() | A | 1OT6 | 0.77 | ![]() | |
HC4![]() | A | 1TS0 | 0.77 | ![]() | |
HC4![]() | A | 1T1A | 0.77 | ![]() | |
HC4![]() | A | 2PYP | 0.77 | ![]() | |
HC4![]() | A | 2ZOI | 0.77 | ![]() | |
HC4![]() | A | 1OTI | 0.77 | ![]() | |
HC4![]() | A | 1XFQ | 0.77 | ![]() | |
HC4![]() | A | 2D01 | 0.77 | ![]() | |
HC4![]() | A,B,C,D,E,F, G,H | 2O7B | 0.77 | ![]() | |
HC4![]() | A | 2ZOH | 0.77 | ![]() | |
HC4![]() | A | 1GSW | 0.77 | ![]() | |
HC4![]() | A | 2QJ7 | 0.77 | ![]() | |
HC4![]() | A | 1F9I | 0.77 | ![]() | |
HC4![]() | X | 1UWP | 0.77 | ![]() | |
HC4![]() | A | 2PHY | 0.77 | ![]() | |
HC4![]() | A | 1T1B | 0.77 | ![]() | |
HC4![]() | A | 1F98 | 0.77 | ![]() | |
HC4![]() | A | 1T19 | 0.77 | ![]() | |
HC4![]() | X | 1UWN | 0.77 | ![]() | |
HC4![]() | A,B,C,D,E,F, G,H | 2O7F | 0.77 | ![]() | |
HC4![]() | A | 1UGU | 0.77 | ![]() | |
HC4![]() | A | 1TS8 | 0.77 | ![]() | |
HC4![]() | A,B | 1OTD | 0.77 | ![]() | |
HC4![]() | A | 1OTE | 0.77 | ![]() | |
HC4![]() | A | 1GSX | 0.77 | ![]() | |
HC4![]() | A | 1TS7 | 0.77 | ![]() | |
HC4![]() | A | 2PYR | 0.77 | ![]() | |
HC4![]() | A | 1S4S | 0.77 | ![]() | |
HC4![]() | A | 1GSV | 0.77 | ![]() | |
HC4![]() | A | 2I9V | 0.77 | ![]() | |
HC4![]() | A | 2QWS | 0.77 | ![]() | |
HC4![]() | A | 1XFN | 0.77 | ![]() | |
HC4![]() | A | 1S4R | 0.77 | ![]() | |
HC4![]() | A | 1T18 | 0.77 | ![]() | |
HC4![]() | A | 1OTA | 0.77 | ![]() | |
HC4![]() | A | 1D7E | 0.77 | ![]() | |
HC4![]() | A | 1S1Z | 0.77 | ![]() | |
HC4![]() | A,B,C | 1MZU | 0.77 | ![]() | |
HC4![]() | A,B | 1ODV | 0.77 | ![]() | |
HC4![]() | A,B | 2J3J | 0.77 | ![]() | |
HC4![]() | A | 2QJ5 | 0.77 | ![]() | |
HC4![]() | A | 1OTB | 0.77 | ![]() | |
HC4![]() | A | 2D02 | 0.77 | ![]() | |
HC4![]() | A | 1OT9 | 0.77 | ![]() | |
HC4![]() | A | 1NWZ | 0.77 | ![]() | |
HC4![]() | A | 1S1Y | 0.77 | ![]() | |
AC6![]() | P-HYDROXYACETOPHENONE | A | 2GQ8 | 0.74 | ![]() |
AC6![]() | P-HYDROXYACETOPHENONE | X | 2O48 | 0.74 | ![]() |
EPT![]() | HEPTANYL-P-PHENOL | A,B | 1AHZ | 0.72 | ![]() |
SN1![]() | 2,4-DIHYDROXY-TRANS CINNAMIC ACID | 1 | 1K2I | 0.71 | ![]() |
2LP![]() | 2-ALLYLPHENOL | A | 1OV5 | 0.71 | ![]() |
AEF![]() | 4-(2-aminoethyl)phenol | A | 3BRA | 0.71 | ![]() |
TOH![]() | (3E)-4-(2-HYDROXYPHENYL)-2-OXOBUT- 3-ENOIC ACID | A | 2IME | 0.73 | ![]() |
TOH![]() | (3E)-4-(2-HYDROXYPHENYL)-2-OXOBUT- 3-ENOIC ACID | A | 2IMD | 0.73 | ![]() |
XYG![]() | [(4Z)-2-[(1Z)-ETHANIMIDOYL]-4-(4- HYDROXYBENZYLIDENE)-5-OXO-4,5-DIHYDRO- 1H-IMIDAZOL-1-YL]ACETIC ACID | A,B | 2PXW | 0.7 | ![]() |
XYG![]() | [(4Z)-2-[(1Z)-ETHANIMIDOYL]-4-(4- HYDROXYBENZYLIDENE)-5-OXO-4,5-DIHYDRO- 1H-IMIDAZOL-1-YL]ACETIC ACID | A,B,C,D | 2FL1 | 0.7 | ![]() |
XYG![]() | [(4Z)-2-[(1Z)-ETHANIMIDOYL]-4-(4- HYDROXYBENZYLIDENE)-5-OXO-4,5-DIHYDRO- 1H-IMIDAZOL-1-YL]ACETIC ACID | A,B | 2PXS | 0.7 | ![]() |
XYG![]() | [(4Z)-2-[(1Z)-ETHANIMIDOYL]-4-(4- HYDROXYBENZYLIDENE)-5-OXO-4,5-DIHYDRO- 1H-IMIDAZOL-1-YL]ACETIC ACID | A,B,C,D | 2ICR | 0.7 | ![]() |
Y13![]() | (2E)-3-(3,4-DIHYDROXYPHENYL)-N- [2-(4-HYDROXYPHENYL)ETHYL]ACRYLAMIDE | A | 2EW6 | 0.73 | ![]() |
DHR![]() | (2S)-HYDROXY(4-HYDROXYPHENYL)ETHANENITRILE | A,B | 1E55 | 0.72 | ![]() |
SAF![]() | 3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL | A | 1GQR | 0.73 | ![]() |
SAF![]() | 3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL | A | 1GQS | 0.73 | ![]() |
SGI![]() | 3-(4-hydroxyphenyl)propanamide | A,B | 2R9K | 0.74 | ![]() |
DES![]() | DIETHYLSTILBESTROL | A,B,C,D | 1S9P | 0.71 | ![]() |
DES![]() | DIETHYLSTILBESTROL | A,B | 3ERD | 0.71 | ![]() |
DES![]() | DIETHYLSTILBESTROL | A,B | 1TT6 | 0.71 | ![]() |
DES![]() | DIETHYLSTILBESTROL | A,B,C,D | 1TZ8 | 0.71 | ![]() |
4HP![]() | 4-HYDROXYPHENYLACETATE | A,B,C,D | 2JBT | 0.71 | ![]() |
4HP![]() | 4-HYDROXYPHENYLACETATE | A | 2YYJ | 0.71 | ![]() |
4HP![]() | 4-HYDROXYPHENYLACETATE | A | 2YYM | 0.71 | ![]() |
4HP![]() | 4-HYDROXYPHENYLACETATE | B | 1AI6 | 0.71 | ![]() |
4HP![]() | 4-HYDROXYPHENYLACETATE | M,N,O,P,Q,R | 3PCG | 0.71 | ![]() |
2HC![]() | (2E)-3-(2-HYDROXYPHENYL)ACRYLIC ACID | A,B | 1V5Z | 0.75 | ![]() |
2MP![]() | 3,4-DIMETHYLPHENOL | A | 1L5O | 0.71 | ![]() |
HPP![]() | HYDROXYPHENYL PROPIONIC ACID | A,B | 2TPL | 0.71 | ![]() |
HPP![]() | HYDROXYPHENYL PROPIONIC ACID | A,B,C,D | 3GGP | 0.71 | ![]() |
F16![]() | 5-(3-HYDROXYPHENYL)ISOTHIAZOL-3(2H)- ONE 1,1-DIOXIDE | A | 2CM8 | 0.71 | ![]() |
TYC![]() | L-TYROSINAMIDE | A | 2BF9 | 0.72 | ![]() |
TYC![]() | L-TYROSINAMIDE | A | 2OCI | 0.72 | ![]() |
AEG![]() | 4-[(2R)-2-aminopropyl]phenol | A | 3BUF | 0.7 | ![]() |
PCR![]() | P-CRESOL | A | 1JHV | 0.74 | ![]() |
PCR![]() | P-CRESOL | A | 1JHU | 0.74 | ![]() |
PCR![]() | P-CRESOL | A,B,C,D | 1DIQ | 0.74 | ![]() |
ETY![]() | 4-ethylphenol | A,B,C,D | 2RA6 | 0.74 | ![]() |
HBD![]() | 4-HYDROXYBENZAMIDE | B,C,D | 1BEN | 0.72 | ![]() |
IHB![]() | 3-IODO-4-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCI | 0.71 | ![]() |
IYR![]() | 3-IODO-TYROSINE | A | 2D98 | 0.7 | ![]() |
IYR![]() | 3-IODO-TYROSINE | A | 2D8P | 0.7 | ![]() |
IYR![]() | 3-IODO-TYROSINE | A,B | 3GFD | 0.7 | ![]() |
IYR![]() | 3-IODO-TYROSINE | A | 2R1Q | 0.7 | ![]() |
IYR![]() | 3-IODO-TYROSINE | A | 2ZP1 | 0.7 | ![]() |
IYR![]() | 3-IODO-TYROSINE | A,B,C,D | 2ZXV | 0.7 | ![]() |
IYR![]() | 3-IODO-TYROSINE | C | 1CF0 | 0.7 | ![]() |
IYR![]() | 3-IODO-TYROSINE | A | 1XXZ | 0.7 | ![]() |
IYR![]() | 3-IODO-TYROSINE | A | 2D97 | 0.7 | ![]() |
IYR![]() | 3-IODO-TYROSINE | A | 1XY9 | 0.7 | ![]() |
IYR![]() | 3-IODO-TYROSINE | A | 2Z10 | 0.7 | ![]() |
IYR![]() | 3-IODO-TYROSINE | A | 1WQ3 | 0.7 | ![]() |
IYR![]() | 3-IODO-TYROSINE | A | 2D8O | 0.7 | ![]() |
IYR![]() | 3-IODO-TYROSINE | A | 2D8W | 0.7 | ![]() |
IYR![]() | 3-IODO-TYROSINE | A | 2Z11 | 0.7 | ![]() |
FHC![]() | 2-FLUORO-3-(4-HYDROXYPHENYL)-2E- PROPENEOATE | A | 2OPA | 0.75 | ![]() |
FHC![]() | 2-FLUORO-3-(4-HYDROXYPHENYL)-2E- PROPENEOATE | A,B,C | 1MFI | 0.75 | ![]() |
FHC![]() | 2-FLUORO-3-(4-HYDROXYPHENYL)-2E- PROPENEOATE | A,B | 1GYY | 0.75 | ![]() |
CRS![]() | M-CRESOL | A,B,C,D | 1EV3 | 0.71 | ![]() |
CRS![]() | M-CRESOL | A,B,C,D,E,F | 2OMG | 0.71 | ![]() |
CRS![]() | M-CRESOL | A,B | 1UZ9 | 0.71 | ![]() |
CRS![]() | M-CRESOL | A,B,C,D | 1ZEH | 0.71 | ![]() |
CRS![]() | M-CRESOL | A,B,C,D,E,F | 1ZEI | 0.71 | ![]() |
CRS![]() | M-CRESOL | A,C,D,E | 7INS | 0.71 | ![]() |
CRS![]() | M-CRESOL | A,B,C,D,E,G, I,K | 1EV6 | 0.71 | ![]() |