Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03212052
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 |
IPB![]() | 5-METHYL-2-(1-METHYLETHYL)PHENOL | A,B | 1E06 | 0.75 | ![]() |
CRS![]() | M-CRESOL | A,B,C,D | 1EV3 | 0.74 | ![]() |
CRS![]() | M-CRESOL | A,B,C,D,E,F | 2OMG | 0.74 | ![]() |
CRS![]() | M-CRESOL | A,B | 1UZ9 | 0.74 | ![]() |
CRS![]() | M-CRESOL | A,B,C,D | 1ZEH | 0.74 | ![]() |
CRS![]() | M-CRESOL | A,B,C,D,E,F | 1ZEI | 0.74 | ![]() |
CRS![]() | M-CRESOL | A,C,D,E | 7INS | 0.74 | ![]() |
CRS![]() | M-CRESOL | A,B,C,D,E,G, I,K | 1EV6 | 0.74 | ![]() |
EPT![]() | HEPTANYL-P-PHENOL | A,B | 1AHZ | 0.74 | ![]() |
NAF![]() | M-(N,N,N-TRIMETHYLAMMONIO)-2,2,2- TRIFLUORO-1,1-DIHYDROXYETHYLBENZENE | A | 1AMN | 0.72 | ![]() |
NAF![]() | M-(N,N,N-TRIMETHYLAMMONIO)-2,2,2- TRIFLUORO-1,1-DIHYDROXYETHYLBENZENE | A,B | 2H9Y | 0.72 | ![]() |
3HA![]() | 3-HYDROXYANTHRANILIC ACID | A,B | 1U1W | 0.73 | ![]() |
3HA![]() | 3-HYDROXYANTHRANILIC ACID | A | 1YFY | 0.73 | ![]() |
790![]() | 1,2,3,4-TETRAHYDROQUINOLIN-8-YL DIHYDROGEN PHOSPHATE | A | 1O4F | 0.7 | ![]() |
EYK![]() | 2-tert-butylbenzene-1,4-diol | D,F | 3EYM | 0.73 | ![]() |
EYK![]() | 2-tert-butylbenzene-1,4-diol | B | 3EYK | 0.73 | ![]() |
4HL![]() | 4-(HYDRAZINOMETHYL)PHENOL | A,B | 2E2U | 0.73 | ![]() |
TYQ![]() | 3-AMINO-6-HYDROXY-TYROSINE | A,B | 1D6Y | 0.7 | ![]() |
TYQ![]() | 3-AMINO-6-HYDROXY-TYROSINE | A,B | 1D6U | 0.7 | ![]() |
2AF![]() | 2-AMINOPHENOL | A | 1L4N | 0.76 | ![]() |
NPO![]() | P-NITROPHENOL | A,B | 1Z44 | 0.74 | ![]() |
NPO![]() | P-NITROPHENOL | X | 2ZYW | 0.74 | ![]() |
NPO![]() | P-NITROPHENOL | H,L | 1YEK | 0.74 | ![]() |
NPO![]() | P-NITROPHENOL | A,C,E,G | 43CA | 0.74 | ![]() |
NPO![]() | P-NITROPHENOL | A | 1LS6 | 0.74 | ![]() |
NPO![]() | P-NITROPHENOL | X | 2ZVP | 0.74 | ![]() |
NPO![]() | P-NITROPHENOL | A,B | 2I10 | 0.74 | ![]() |
NPO![]() | P-NITROPHENOL | A | 1VAH | 0.74 | ![]() |
NPO![]() | P-NITROPHENOL | A,B | 3ETT | 0.74 | ![]() |
NPO![]() | P-NITROPHENOL | A,B | 2D20 | 0.74 | ![]() |
NPO![]() | P-NITROPHENOL | X | 2ZYV | 0.74 | ![]() |
2AC![]() | 2-AMINO-P-CRESOL | H,I | 1A2C | 0.83 | ![]() |
2AC![]() | 2-AMINO-P-CRESOL | A | 1L4M | 0.83 | ![]() |
D4P![]() | (2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACID | A | 1DSR | 0.71 | ![]() |
D4P![]() | (2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D,E,F, G,H | 1W7R | 0.71 | ![]() |
D4P![]() | (2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1W7Q | 0.71 | ![]() |
PCR![]() | P-CRESOL | A | 1JHV | 0.71 | ![]() |
PCR![]() | P-CRESOL | A | 1JHU | 0.71 | ![]() |
PCR![]() | P-CRESOL | A,B,C,D | 1DIQ | 0.71 | ![]() |
1OH![]() | 4-(1-methyl-1-phenylethyl)phenol | A | 2ZAS | 0.71 | ![]() |
LYL![]() | 2-ALLYL-6-METHYL-PHENOL | A | 1OV7 | 0.75 | ![]() |
SAF![]() | 3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL | A | 1GQR | 0.81 | ![]() |
SAF![]() | 3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL | A | 1GQS | 0.81 | ![]() |
B3Y![]() | (3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACID | A | 3HF0 | 0.7 | ![]() |
B3Y![]() | (3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACID | A | 2OXK | 0.7 | ![]() |
B3Y![]() | (3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACID | A,B,C | 2OXJ | 0.7 | ![]() |
TY2![]() | 3-AMINO-L-TYROSINE | A,B | 2VH3 | 0.73 | ![]() |
LDP![]() | L-DOPAMINE | A,B | 2A3R | 0.75 | ![]() |
LDP![]() | L-DOPAMINE | A | 5PAH | 0.75 | ![]() |
LDP![]() | L-DOPAMINE | A,B | 2QMZ | 0.75 | ![]() |
LDP![]() | L-DOPAMINE | A,B | 2VQ5 | 0.75 | ![]() |
RHP![]() | (3R)-3-(PROP-2-YNYLAMINO)INDAN- 5-OL | A,B | 1S3E | 0.73 | ![]() |
OTR![]() | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGT | 0.72 | ![]() |
OTR![]() | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG2 | 0.72 | ![]() |
OTR![]() | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 2AN4 | 0.72 | ![]() |
A48![]() | 4-[(DIMESITYLBORYL)(2,2,2-TRIFLUOROETHYL)AMINO]PHENOL | A,B | 2Q6J | 0.75 | ![]() |
2MP![]() | 3,4-DIMETHYLPHENOL | A | 1L5O | 0.73 | ![]() |
DMB![]() | A,B | 1SRI | 0.73 | ![]() | |
BHQ![]() | 2,5-DITERT-BUTYLBENZENE-1,4-DIOL | A,B | 2AGV | 0.71 | ![]() |
HAB![]() | A,B | 1SRE | 0.72 | ![]() | |
AEG![]() | 4-[(2R)-2-aminopropyl]phenol | A | 3BUF | 0.79 | ![]() |
CZM![]() | 'N,N'-BIS-(2-HYDROXY-3-METHYL-BENZYLIDENE)- BENZENE-1,2-DIAMINE' | A | 1J3F | 0.72 | ![]() |
CZM![]() | 'N,N'-BIS-(2-HYDROXY-3-METHYL-BENZYLIDENE)- BENZENE-1,2-DIAMINE' | A | 1UFJ | 0.72 | ![]() |
CZM![]() | 'N,N'-BIS-(2-HYDROXY-3-METHYL-BENZYLIDENE)- BENZENE-1,2-DIAMINE' | A | 1V9Q | 0.72 | ![]() |
4A3![]() | 4-AMINO-3-HYDROXYBENZOIC ACID | A,B | 2HDR | 0.7 | ![]() |
OTS![]() | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG2 | 0.72 | ![]() |
OTS![]() | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG1 | 0.72 | ![]() |
OTS![]() | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RH0 | 0.72 | ![]() |
OTS![]() | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGU | 0.72 | ![]() |
OTS![]() | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGT | 0.72 | ![]() |
D3P![]() | (2R)-AMINO(3,5-DIHYDROXYPHENYL)ACETIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1W7Q | 0.7 | ![]() |
D3P![]() | (2R)-AMINO(3,5-DIHYDROXYPHENYL)ACETIC ACID | A,B,C,D,E,F, G,H | 1W7R | 0.7 | ![]() |
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 | 0.71 | ![]() |
2LP![]() | 2-ALLYLPHENOL | A | 1OV5 | 0.73 | ![]() |
PFL![]() | 2,6-BIS(1-METHYLETHYL)PHENOL | A,B | 1E7A | 0.73 | ![]() |
HXS![]() | 4-[(1R,2S)-1-ethyl-2-(4-hydroxyphenyl)butyl]phenol | A,B | 3CV6 | 0.7 | ![]() |
MTB![]() | A,B | 1SRF | 0.71 | ![]() | |
RM2![]() | 4-HYDROXY-N-PROPARGYL-1(R)-AMINOINDAN | A,B | 2C66 | 0.72 | ![]() |
DGH![]() | (2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1W7Q | 0.71 | ![]() |
DGH![]() | (2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D,E,F, G,H | 1W7R | 0.71 | ![]() |
FEN![]() | N-(4-HYDROXYPHENYL)ALL-TRANS RETINAMIDE | A | 1FEL | 0.75 | ![]() |
SOA![]() | ISATOIC ANHYDRIDE | A | 1BIO | 0.77 | ![]() |
2OH![]() | 4,4'-PROPANE-2,2-DIYLDIPHENOL | A | 2E2R | 0.7 | ![]() |
2OH![]() | 4,4'-PROPANE-2,2-DIYLDIPHENOL | A | 2P7G | 0.7 | ![]() |
AEH![]() | 4-(2-aminoethyl)-2-ethylphenol | A | 3BUG | 0.79 | ![]() |
MHB![]() | A,B | 1SRG | 0.72 | ![]() | |
ETY![]() | 4-ethylphenol | A,B,C,D | 2RA6 | 0.73 | ![]() |
SGI![]() | 3-(4-hydroxyphenyl)propanamide | A,B | 2R9K | 0.72 | ![]() |
AZY![]() | 3-AZIDO-L-TYROSINE | A | 2YXN | 0.72 | ![]() |
NCR![]() | 2-NITRO-P-CRESOL | A,B | 1AHV | 0.74 | ![]() |
DNT![]() | 2-[1-METHYLHEXYL]-4,6-DINITROPHENOL | A,B,C | 1NEN | 0.75 | ![]() |
MTY![]() | META-TYROSINE | A | 2TOH | 0.71 | ![]() |
MTY![]() | META-TYROSINE | A,B | 1BIQ | 0.71 | ![]() |
MTY![]() | META-TYROSINE | A | 1Q7O | 0.71 | ![]() |
AEF![]() | 4-(2-aminoethyl)phenol | A | 3BRA | 0.77 | ![]() |
GHP![]() | 4-HYDROXYPHENYLGLYCINE | A | 1DSR | 0.71 | ![]() |
MA0![]() | (1R)-6-HYDROXY-N-METHYL-N-[(1Z)- PROP-2-EN-1-YLIDENE]INDAN-1-AMINIUM | A,B | 2C64 | 0.71 | ![]() |
TN1![]() | 5,6,7,8-TETRAHYDRONAPHTHALEN-1- OL | A | 1YSG | 0.71 | ![]() |
4NL![]() | 4-AMINOPHENOL | A | 2ORL | 0.81 | ![]() |
AED![]() | 4-(2-aminoethyl)-2-cyclohexylphenol | A | 3BUH | 0.75 | ![]() |
AHT![]() | 4-(2,5-DIAMINO-5-HYDROXY-PENTYL)- PHENOL | I,T | 1TMB | 0.75 | ![]() |
TYL![]() | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | B,C,D | 1TYM | 0.74 | ![]() |
TYL![]() | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | B,C,D | 1TYL | 0.74 | ![]() |
TYL![]() | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | A | 2OCU | 0.74 | ![]() |
TYL![]() | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | A,B,C,D,F | 3DJI | 0.74 | ![]() |
TYL![]() | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | A | 2DPZ | 0.74 | ![]() |