Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02253264
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 |
IPH | PHENOL | A,B | 2OLD | 0.72 | |
IPH | PHENOL | A,B,C,D | 2PZV | 0.72 | |
IPH | PHENOL | A | 1LI2 | 0.72 | |
IPH | PHENOL | A | 2J9N | 0.72 | |
IPH | PHENOL | A,B,C,D | 2OMB | 0.72 | |
IPH | PHENOL | A | 1JHX | 0.72 | |
IPH | PHENOL | A,B,C,D | 2VE7 | 0.72 | |
IPH | PHENOL | B,D,E,G,H,J,L | 1AI0 | 0.72 | |
IPH | PHENOL | A,B,C,D | 1FOH | 0.72 | |
IPH | PHENOL | A | 1V03 | 0.72 | |
IPH | PHENOL | A,C,E,G,I,K | 5AIY | 0.72 | |
IPH | PHENOL | B,D,F,H,J,L | 1AIY | 0.72 | |
IPH | PHENOL | A,B | 1XU5 | 0.72 | |
IPH | PHENOL | A,B,C,D,E,G, I,K | 1W8P | 0.72 | |
IPH | PHENOL | A,C,E,G,I,K | 4AIY | 0.72 | |
IPH | PHENOL | A,B,C,D,E,F, G,H | 1XDA | 0.72 | |
IPH | PHENOL | A | 2AS3 | 0.72 | |
IPH | PHENOL | A,B,C,D | 1ZEG | 0.72 | |
IPH | PHENOL | A,B,C,D | 1PN0 | 0.72 | |
IPH | PHENOL | A,B,C,D | 1XW7 | 0.72 | |
IPH | PHENOL | A,C,E,G,I,K,M | 1QIY | 0.72 | |
IPH | PHENOL | A,B,C,D | 1Q4V | 0.72 | |
IPH | PHENOL | B | 1AI7 | 0.72 | |
IPH | PHENOL | A | 1FJW | 0.72 | |
IPH | PHENOL | B,C,D | 1RWE | 0.72 | |
IPH | PHENOL | A,B,C,D,E,G, H,I,K | 1ZNJ | 0.72 | |
IPH | PHENOL | B,C,D | 3GKY | 0.72 | |
IPH | PHENOL | A | 1JHY | 0.72 | |
IPH | PHENOL | A,C,E,G,I,K | 3AIY | 0.72 | |
IPH | PHENOL | A,B | 2OMN | 0.72 | |
IPH | PHENOL | A,C,E,G,I,K | 2AIY | 0.72 | |
IPH | PHENOL | A,B,D | 1MPJ | 0.72 | |
IPH | PHENOL | A,B,C,D,F,G, H,J | 1WAV | 0.72 | |
IPH | PHENOL | B,C,D | 1LPH | 0.72 | |
HXS | 4-[(1R,2S)-1-ethyl-2-(4-hydroxyphenyl)butyl]phenol | A,B | 3CV6 | 0.71 | |
PCI | PENTACHLOROPHENOL | A,B | 2GWH | 0.73 | |
PCI | PENTACHLOROPHENOL | A,B,C | 1Y5N | 0.73 | |
PCI | PENTACHLOROPHENOL | A,B,C | 1Y4Z | 0.73 | |
PCI | PENTACHLOROPHENOL | A,B,C,E,F,G | 2VPY | 0.73 | |
BP3 | 2'-CHLORO-BIPHENYL-2,3-DIOL | A | 1LGT | 0.74 | |
HC4 | A | 1TS6 | 0.72 | ||
HC4 | A | 3PHY | 0.72 | ||
HC4 | A | 3PYP | 0.72 | ||
HC4 | A | 1T1C | 0.72 | ||
HC4 | A | 1OT6 | 0.72 | ||
HC4 | A | 1TS0 | 0.72 | ||
HC4 | A | 1T1A | 0.72 | ||
HC4 | A | 2PYP | 0.72 | ||
HC4 | A | 2ZOI | 0.72 | ||
HC4 | A | 1OTI | 0.72 | ||
HC4 | A | 1XFQ | 0.72 | ||
HC4 | A | 2D01 | 0.72 | ||
HC4 | A,B,C,D,E,F, G,H | 2O7B | 0.72 | ||
HC4 | A | 2ZOH | 0.72 | ||
HC4 | A | 1GSW | 0.72 | ||
HC4 | A | 2QJ7 | 0.72 | ||
HC4 | A | 1F9I | 0.72 | ||
HC4 | X | 1UWP | 0.72 | ||
HC4 | A | 2PHY | 0.72 | ||
HC4 | A | 1T1B | 0.72 | ||
HC4 | A | 1F98 | 0.72 | ||
HC4 | A | 1T19 | 0.72 | ||
HC4 | X | 1UWN | 0.72 | ||
HC4 | A,B,C,D,E,F, G,H | 2O7F | 0.72 | ||
HC4 | A | 1UGU | 0.72 | ||
HC4 | A | 1TS8 | 0.72 | ||
HC4 | A,B | 1OTD | 0.72 | ||
HC4 | A | 1OTE | 0.72 | ||
HC4 | A | 1GSX | 0.72 | ||
HC4 | A | 1TS7 | 0.72 | ||
HC4 | A | 2PYR | 0.72 | ||
HC4 | A | 1S4S | 0.72 | ||
HC4 | A | 1GSV | 0.72 | ||
HC4 | A | 2I9V | 0.72 | ||
HC4 | A | 2QWS | 0.72 | ||
HC4 | A | 1XFN | 0.72 | ||
HC4 | A | 1S4R | 0.72 | ||
HC4 | A | 1T18 | 0.72 | ||
HC4 | A | 1OTA | 0.72 | ||
HC4 | A | 1D7E | 0.72 | ||
HC4 | A | 1S1Z | 0.72 | ||
HC4 | A,B,C | 1MZU | 0.72 | ||
HC4 | A,B | 1ODV | 0.72 | ||
HC4 | A,B | 2J3J | 0.72 | ||
HC4 | A | 2QJ5 | 0.72 | ||
HC4 | A | 1OTB | 0.72 | ||
HC4 | A | 2D02 | 0.72 | ||
HC4 | A | 1OT9 | 0.72 | ||
HC4 | A | 1NWZ | 0.72 | ||
HC4 | A | 1S1Y | 0.72 | ||
3CH | 3-CHLOROPHENOL | A | 1LI3 | 0.81 | |
PCR | P-CRESOL | A | 1JHV | 0.81 | |
PCR | P-CRESOL | A | 1JHU | 0.81 | |
PCR | P-CRESOL | A,B,C,D | 1DIQ | 0.81 | |
CHB | 3-CHLORO-4-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCH | 0.76 | |
FHC | 2-FLUORO-3-(4-HYDROXYPHENYL)-2E- PROPENEOATE | A | 2OPA | 0.71 | |
FHC | 2-FLUORO-3-(4-HYDROXYPHENYL)-2E- PROPENEOATE | A,B,C | 1MFI | 0.71 | |
FHC | 2-FLUORO-3-(4-HYDROXYPHENYL)-2E- PROPENEOATE | A,B | 1GYY | 0.71 | |
4NA | 1-CHLORO-6-(4-HYDROXYPHENYL)-2- NAPHTHOL | A,B | 1YY4 | 0.74 | |
ETY | 4-ethylphenol | A,B,C,D | 2RA6 | 0.79 | |
1OH | 4-(1-methyl-1-phenylethyl)phenol | A | 2ZAS | 0.71 | |
C2U | 3,5-dichloro-2-hydroxybenzoic acid | A | 3C3U | 0.77 | |
C2U | 3,5-dichloro-2-hydroxybenzoic acid | A | 3CV7 | 0.77 | |
TC7 | 2,4,5-trichlorophenol | A | 2VCE | 0.8 | |
2CH | 2-CHLOROPHENOL | A | 1WBO | 0.85 | |
2OH | 4,4'-PROPANE-2,2-DIYLDIPHENOL | A | 2E2R | 0.71 | |
2OH | 4,4'-PROPANE-2,2-DIYLDIPHENOL | A | 2P7G | 0.71 | |
EPT | HEPTANYL-P-PHENOL | A,B | 1AHZ | 0.77 | |
43M | 4-CHLORO-3-METHYLPHENOL | A | 2P7A | 0.86 | |
8PP | 2-[(2E,6E,10E,14E,18E,22E,26E)- 3,7,11,15,19,23,27,31-OCTAMETHYLDOTRIACONTA- 2,6,10,14,18,22,26,30-OCTAENYL]PHENOL | A,B,C,D | 1Y0G | 0.73 | |
MBD | 3-METHYLCATECHOL | A | 1KNF | 0.72 | |
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 | |
NE2 | 3,3',4',5-TETRACHLOROBIPHENYL-4- OL | A,B | 2GAB | 0.85 | |
IPB | 5-METHYL-2-(1-METHYLETHYL)PHENOL | A,B | 1E06 | 0.72 | |
CRS | M-CRESOL | A,B,C,D | 1EV3 | 0.78 | |
CRS | M-CRESOL | A,B,C,D,E,F | 2OMG | 0.78 | |
CRS | M-CRESOL | A,B | 1UZ9 | 0.78 | |
CRS | M-CRESOL | A,B,C,D | 1ZEH | 0.78 | |
CRS | M-CRESOL | A,B,C,D,E,F | 1ZEI | 0.78 | |
CRS | M-CRESOL | A,C,D,E | 7INS | 0.78 | |
CRS | M-CRESOL | A,B,C,D,E,G, I,K | 1EV6 | 0.78 | |
FCR | ALPHA,ALPHA,ALPHA-TRIFLUORO-P-CRESOL | A,B | 1E0Y | 0.77 | |
FCR | ALPHA,ALPHA,ALPHA-TRIFLUORO-P-CRESOL | A,B | 1E8G | 0.77 | |
LYL | 2-ALLYL-6-METHYL-PHENOL | A | 1OV7 | 0.76 | |
PFL | 2,6-BIS(1-METHYLETHYL)PHENOL | A,B | 1E7A | 0.73 | |
BP6 | 2',6'-DICHLORO-BIPHENYL-2,6-DIOL | A | 1LKD | 0.76 | |
2LP | 2-ALLYLPHENOL | A | 1OV5 | 0.75 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D | 3E5U | 0.81 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B | 3E6B | 0.81 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D | 3E5X | 0.81 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B | 2H6B | 0.81 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | C | 3E6C | 0.81 | |
LJ1 | 2,6-dimethyl-4-[(E)-2-phenylethenyl]phenol | A,B | 3CN0 | 0.74 | |
2MP | 3,4-DIMETHYLPHENOL | A | 1L5O | 0.76 | |
34C | (3-CHLORO-4-PROPOXY-PHENYL)-ACETIC ACID | A,B | 1HT8 | 0.7 | |
MCT | 4-METHYLCATECHOL | A | 1L4G | 0.74 | |
MCT | 4-METHYLCATECHOL | A | 2EHZ | 0.74 | |
MCT | 4-METHYLCATECHOL | A,B | 1DMH | 0.74 | |
269 | (1R)-3-chloro-1-phenylpropan-1- ol | A | 2RBS | 0.7 | |
PCQ | 3,5,3',5'-TETRACHLORO-BIPHENYL- 4,4'-DIOL | A,B | 1G3M | 0.88 | |
PCQ | 3,5,3',5'-TETRACHLORO-BIPHENYL- 4,4'-DIOL | A,B | 2G5U | 0.88 | |
NE1 | 2',3,3',4',5-PENTACHLOROBIPHENYL- 4-OL | A,B | 2G9K | 0.84 |