Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03215630
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 |
TYL | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | B,C,D | 1TYM | 0.71 | |
TYL | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | B,C,D | 1TYL | 0.71 | |
TYL | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | A | 2OCU | 0.71 | |
TYL | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | A,B,C,D,F | 3DJI | 0.71 | |
TYL | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | A | 2DPZ | 0.71 | |
NCR | 2-NITRO-P-CRESOL | A,B | 1AHV | 0.79 | |
ETY | 4-ethylphenol | A,B,C,D | 2RA6 | 0.71 | |
A48 | 4-[(DIMESITYLBORYL)(2,2,2-TRIFLUOROETHYL)AMINO]PHENOL | A,B | 2Q6J | 0.72 | |
CRS | M-CRESOL | A,B,C,D | 1EV3 | 0.73 | |
CRS | M-CRESOL | A,B,C,D,E,F | 2OMG | 0.73 | |
CRS | M-CRESOL | A,B | 1UZ9 | 0.73 | |
CRS | M-CRESOL | A,B,C,D | 1ZEH | 0.73 | |
CRS | M-CRESOL | A,B,C,D,E,F | 1ZEI | 0.73 | |
CRS | M-CRESOL | A,C,D,E | 7INS | 0.73 | |
CRS | M-CRESOL | A,B,C,D,E,G, I,K | 1EV6 | 0.73 | |
4A3 | 4-AMINO-3-HYDROXYBENZOIC ACID | A,B | 2HDR | 0.75 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG2 | 0.7 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG1 | 0.7 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RH0 | 0.7 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGU | 0.7 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGT | 0.7 | |
2AC | 2-AMINO-P-CRESOL | H,I | 1A2C | 0.88 | |
2AC | 2-AMINO-P-CRESOL | A | 1L4M | 0.88 | |
CZM | 'N,N'-BIS-(2-HYDROXY-3-METHYL-BENZYLIDENE)- BENZENE-1,2-DIAMINE' | A | 1J3F | 0.7 | |
CZM | 'N,N'-BIS-(2-HYDROXY-3-METHYL-BENZYLIDENE)- BENZENE-1,2-DIAMINE' | A | 1UFJ | 0.7 | |
CZM | 'N,N'-BIS-(2-HYDROXY-3-METHYL-BENZYLIDENE)- BENZENE-1,2-DIAMINE' | A | 1V9Q | 0.7 | |
4NL | 4-AMINOPHENOL | A | 2ORL | 0.77 | |
4HL | 4-(HYDRAZINOMETHYL)PHENOL | A,B | 2E2U | 0.72 | |
2AF | 2-AMINOPHENOL | A | 1L4N | 0.82 | |
NPO | P-NITROPHENOL | A,B | 1Z44 | 0.7 | |
NPO | P-NITROPHENOL | X | 2ZYW | 0.7 | |
NPO | P-NITROPHENOL | H,L | 1YEK | 0.7 | |
NPO | P-NITROPHENOL | A,C,E,G | 43CA | 0.7 | |
NPO | P-NITROPHENOL | A | 1LS6 | 0.7 | |
NPO | P-NITROPHENOL | X | 2ZVP | 0.7 | |
NPO | P-NITROPHENOL | A,B | 2I10 | 0.7 | |
NPO | P-NITROPHENOL | A | 1VAH | 0.7 | |
NPO | P-NITROPHENOL | A,B | 3ETT | 0.7 | |
NPO | P-NITROPHENOL | A,B | 2D20 | 0.7 | |
NPO | P-NITROPHENOL | X | 2ZYV | 0.7 | |
OTR | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGT | 0.7 | |
OTR | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG2 | 0.7 | |
OTR | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 2AN4 | 0.7 | |
NIY | META-NITRO-TYROSINE | A | 2ADP | 0.7 | |
NIY | META-NITRO-TYROSINE | A | 3DIV | 0.7 | |
NIY | META-NITRO-TYROSINE | A | 2H5U | 0.7 | |
NIY | META-NITRO-TYROSINE | A | 1K4Q | 0.7 | |
NIY | META-NITRO-TYROSINE | B,G,O,Y | 1SDA | 0.7 | |
FEN | N-(4-HYDROXYPHENYL)ALL-TRANS RETINAMIDE | A | 1FEL | 0.71 | |
EPT | HEPTANYL-P-PHENOL | A,B | 1AHZ | 0.7 | |
AEG | 4-[(2R)-2-aminopropyl]phenol | A | 3BUF | 0.75 | |
TY2 | 3-AMINO-L-TYROSINE | A,B | 2VH3 | 0.76 | |
LYL | 2-ALLYL-6-METHYL-PHENOL | A | 1OV7 | 0.71 | |
AZY | 3-AZIDO-L-TYROSINE | A | 2YXN | 0.74 | |
SAF | 3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL | A | 1GQR | 0.75 | |
SAF | 3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL | A | 1GQS | 0.75 | |
790 | 1,2,3,4-TETRAHYDROQUINOLIN-8-YL DIHYDROGEN PHOSPHATE | A | 1O4F | 0.71 | |
AEF | 4-(2-aminoethyl)phenol | A | 3BRA | 0.74 | |
LDP | L-DOPAMINE | A,B | 2A3R | 0.71 | |
LDP | L-DOPAMINE | A | 5PAH | 0.71 | |
LDP | L-DOPAMINE | A,B | 2QMZ | 0.71 | |
LDP | L-DOPAMINE | A,B | 2VQ5 | 0.71 | |
AED | 4-(2-aminoethyl)-2-cyclohexylphenol | A | 3BUH | 0.72 | |
2MP | 3,4-DIMETHYLPHENOL | A | 1L5O | 0.71 | |
SOA | ISATOIC ANHYDRIDE | A | 1BIO | 0.75 | |
PCR | P-CRESOL | A | 1JHV | 0.7 | |
PCR | P-CRESOL | A | 1JHU | 0.7 | |
PCR | P-CRESOL | A,B,C,D | 1DIQ | 0.7 | |
3HA | 3-HYDROXYANTHRANILIC ACID | A,B | 1U1W | 0.76 | |
3HA | 3-HYDROXYANTHRANILIC ACID | A | 1YFY | 0.76 | |
IPB | 5-METHYL-2-(1-METHYLETHYL)PHENOL | A,B | 1E06 | 0.71 | |
DNT | 2-[1-METHYLHEXYL]-4,6-DINITROPHENOL | A,B,C | 1NEN | 0.74 | |
AEH | 4-(2-aminoethyl)-2-ethylphenol | A | 3BUG | 0.76 |