Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00014571
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 |
HPH | PHENYLALANINDIOL | I | 1E5O | 0.77 | |
HPH | PHENYLALANINDIOL | A,B | 1ODX | 0.77 | |
HPH | PHENYLALANINDIOL | A,B | 1MTB | 0.77 | |
HPH | PHENYLALANINDIOL | A,B | 2FGV | 0.77 | |
HPH | PHENYLALANINDIOL | A | 1ODW | 0.77 | |
HPH | PHENYLALANINDIOL | A,B | 2FGU | 0.77 | |
HPH | PHENYLALANINDIOL | A,B | 1HXB | 0.77 | |
TA2 | (2R,3S)-3-AMINO-3-PHENYLPROPANE- 1,2-DIOL | A,B | 2IFR | 0.8 | |
MNN | (S)-MANDELIC ACID NITRILE | A | 1YB6 | 0.79 | |
412 | (R)-1-(4-(4-(HYDROXYMETHYL)-1,3,2- DIOXABOROLAN-2-YL)PHENETHYL)GUANIDINE | A | 1ZML | 0.72 | |
24B | (2,4-DIFLUOROPHENYL)METHANOL | A,B | 1QV6 | 0.73 | |
2PM | N-[2-(BENZHYDRYLOXY)ETHYL]-N,N- DIMETHYLAMINE | A,B | 2AOT | 0.73 | |
AEG | 4-[(2R)-2-aminopropyl]phenol | A | 3BUF | 0.8 | |
APL | N-(1-BENZYL-3,3,3-TRIFLUORO-2,2- DIHYDROXY-PROPYL)-ACETAMIDE | B,C | 1GG6 | 0.73 | |
NDH | (1R, 2S)-CIS 1,2 DIHYDROXY-1,2- DIHYDRONAPHTHALENE | A,B | 1O7P | 0.74 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1GBM | 0.7 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1GBD | 0.7 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1P06 | 0.7 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1GBI | 0.7 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 8LPR | 0.7 | |
BBL | N-[(BENZYLOXY)CARBONYL]-L-ALANINE | A,I | 2H9H | 0.72 | |
BBL | N-[(BENZYLOXY)CARBONYL]-L-ALANINE | A,I | 2HAL | 0.72 | |
BBL | N-[(BENZYLOXY)CARBONYL]-L-ALANINE | A | 2A4O | 0.72 | |
BBL | N-[(BENZYLOXY)CARBONYL]-L-ALANINE | A,I | 2H6M | 0.72 | |
BBL | N-[(BENZYLOXY)CARBONYL]-L-ALANINE | A | 2CXV | 0.72 | |
SB7 | [HYDROXY(3-PHENYLPROPYL)AMINO]METHANOL | A | 2AI7 | 0.72 | |
SB7 | [HYDROXY(3-PHENYLPROPYL)AMINO]METHANOL | A,B,C | 2AI8 | 0.72 | |
ZAE | N-methyl-D-phenylalanine | H,I,R | 1TBZ | 0.72 | |
CT1 | (1R)-2-METHYL-1-(PHENYLMETHYL)PROPYL[(1S)- 1-FORMYLPENTYL]CARBAMATE | A | 2AUX | 0.7 | |
AEF | 4-(2-aminoethyl)phenol | A | 3BRA | 0.79 | |
DHR | (2S)-HYDROXY(4-HYDROXYPHENYL)ETHANENITRILE | A,B | 1E55 | 0.7 | |
SFX | (3S)-N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan- 1-amine | A | 3GWW | 0.73 | |
12M | (2-ETHYLPHENYL)METHANOL | A,B | 2F62 | 0.79 | |
SS2 | (1R)-1-PHENYLETHANOL | A | 1ZK0 | 0.83 | |
SS2 | (1R)-1-PHENYLETHANOL | A | 1ZJZ | 0.83 | |
SS2 | (1R)-1-PHENYLETHANOL | A | 1ZJY | 0.83 | |
341 | (3,5-difluorophenyl)methanol | C | 3EON | 0.72 | |
4BZ | 4-(HYDROXYMETHYL)BENZAMIDINE | A | 1S6H | 0.73 | |
PDH | (2S)-2-AMINO-3-PHENYL-1-PROPANOL | A | 1GQ0 | 0.8 | |
1ZN | (2S,3S,4E,6E,8S,9S)-3-amino-9-methoxy- 2,6,8-trimethyl-10-phenyldeca-4,6- dienoic acid | C,F,M,N | 2IAE | 0.73 | |
269 | (1R)-3-chloro-1-phenylpropan-1- ol | A | 2RBS | 0.76 | |
G27 | (3R,4R,5R)-5-(HYDROXYMETHYL)-1- (3-PHENYLPROPYL)PIPERIDINE-3,4- DIOL | A | 2G9R | 0.71 | |
G27 | (3R,4R,5R)-5-(HYDROXYMETHYL)-1- (3-PHENYLPROPYL)PIPERIDINE-3,4- DIOL | A | 2G9U | 0.71 | |
PHL | L-PHENYLALANINOL | A,B | 1JOH | 0.8 | |
PHL | L-PHENYLALANINOL | I | 3APR | 0.8 | |
PHL | L-PHENYLALANINOL | A | 1DLZ | 0.8 | |
PHL | L-PHENYLALANINOL | A | 1IH9 | 0.8 | |
PHL | L-PHENYLALANINOL | A | 1OB4 | 0.8 | |
PHL | L-PHENYLALANINOL | I | 2ER6 | 0.8 | |
PHL | L-PHENYLALANINOL | A | 1R9U | 0.8 | |
PHL | L-PHENYLALANINOL | A | 1OB7 | 0.8 | |
PHL | L-PHENYLALANINOL | A,B | 1OB6 | 0.8 | |
PHL | L-PHENYLALANINOL | A,B,C | 1AMT | 0.8 | |
RFX | (3R)-N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan- 1-amine | A | 3GWV | 0.73 | |
MXN | (2R)-hydroxy(phenyl)ethanenitrile | A,B | 3GDN | 0.79 | |
LDP | L-DOPAMINE | A,B | 2A3R | 0.74 | |
LDP | L-DOPAMINE | A | 5PAH | 0.74 | |
LDP | L-DOPAMINE | A,B | 2QMZ | 0.74 | |
LDP | L-DOPAMINE | A,B | 2VQ5 | 0.74 | |
SGI | 3-(4-hydroxyphenyl)propanamide | A,B | 2R9K | 0.71 | |
ALE | L-EPINEPHRINE | A | 3PAH | 0.78 | |
ALE | L-EPINEPHRINE | A | 2HKK | 0.78 | |
PPP | 3-PHENYL-1,2-PROPANDIOL | A,B | 1HRN | 0.74 | |
K7I | L-alanyl-N-[(1S,2R)-1-benzyl-2- hydroxypropyl]-L-alaninamide | A,B | 2QXG | 0.74 | |
DFB | 2,3-DIFLUOROBENZYL ALCOHOL | A,B | 1QV7 | 0.73 | |
DFB | 2,3-DIFLUOROBENZYL ALCOHOL | A,B,C,D | 1MG0 | 0.73 | |
15M | (5Z)-7-{(1R,2R,3R,5S)-3,5-DIHYDROXY- 2-[(1E,3S)-3-HYDROXY-5-PHENYLPENT- 1-ENYL]CYCLOPENTYL}-N-ETHYLHEPT- 5-ENAMIDE | A | 2F38 | 0.78 | |
LYL | 2-ALLYL-6-METHYL-PHENOL | A | 1OV7 | 0.71 | |
RHP | (3R)-3-(PROP-2-YNYLAMINO)INDAN- 5-OL | A,B | 1S3E | 0.71 | |
PEL | 2-PHENYL-ETHANOL | A,B | 1I0D | 0.74 | |
PEL | 2-PHENYL-ETHANOL | D,H | 2I0T | 0.74 | |
PEL | 2-PHENYL-ETHANOL | A,B | 1HZY | 0.74 | |
PEL | 2-PHENYL-ETHANOL | A,B | 1I0B | 0.74 | |
PEL | 2-PHENYL-ETHANOL | A | 1EYW | 0.74 | |
PEL | 2-PHENYL-ETHANOL | A,B | 1JGM | 0.74 | |
BJI | 1(R)-1-ACETAMIDO-2-(3-CARBOXYPHENYL)ETHYL BORONIC ACID | A | 1ERM | 0.73 | |
CTL | CIS-(1R,2S)-2-AMINO-1,2,3,4-TETRAHYDRONAPHTHALEN- 1-OL | A,B | 2AN3 | 0.83 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | A,B,M,N | 1FJM | 0.73 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | A | 1EVA | 0.73 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | A | 1LCM | 0.73 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | A,B,C,D,E,F, G,H | 2NYM | 0.73 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | C,I | 2IE3 | 0.73 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | C,F,X,Y | 2NPP | 0.73 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | A | 1EVC | 0.73 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | C,F,G,H | 3DW8 | 0.73 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | A,B,C,D,E,F, G,H | 2NYL | 0.73 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | A | 1EVD | 0.73 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | A | 1EVB | 0.73 | |
SEM | 3-AMINO-4-OXYBENZYL-2-BUTANONE | A,B | 1THE | 0.72 | |
ETY | 4-ethylphenol | A,B,C,D | 2RA6 | 0.7 | |
AHT | 4-(2,5-DIAMINO-5-HYDROXY-PENTYL)- PHENOL | I,T | 1TMB | 0.77 | |
SAF | 3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL | A | 1GQR | 0.74 | |
SAF | 3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL | A | 1GQS | 0.74 | |
LNR | L-NOREPINEPHRINE | A,B | 2QEO | 0.75 | |
LNR | L-NOREPINEPHRINE | A | 3DYE | 0.75 | |
LNR | L-NOREPINEPHRINE | A | 4PAH | 0.75 | |
DTY | D-TYROSINE | A | 1C4B | 0.7 | |
DTY | D-TYROSINE | A,L | 1ZEA | 0.7 | |
DTY | D-TYROSINE | A,B,C,D,E,F, G,H | 1OF6 | 0.7 | |
DTY | D-TYROSINE | A,B | 1UNO | 0.7 | |
DTY | D-TYROSINE | A | 2IGZ | 0.7 | |
DTY | D-TYROSINE | A,B,C,H,K,L | 2R5D | 0.7 | |
DTY | D-TYROSINE | A,B | 2Q33 | 0.7 | |
DTY | D-TYROSINE | H,S | 2H9E | 0.7 | |
DTY | D-TYROSINE | A,B,C,H,K,L | 2R5B | 0.7 | |
DTY | D-TYROSINE | A | 2IH0 | 0.7 | |
DTY | D-TYROSINE | A | 1D7T | 0.7 | |
DTY | D-TYROSINE | A,B | 1XA0 | 0.7 | |
EOA | N-PHENETHYL-FORMAMIDE | H,I | 1A5G | 0.71 | |
MEA | N-METHYLPHENYLALANINE | A | 2PIL | 0.72 | |
MEA | N-METHYLPHENYLALANINE | A,B,C,D | 1H0I | 0.72 | |
MEA | N-METHYLPHENYLALANINE | A,B,I | 1DOJ | 0.72 | |
4FA | 4-FLUOROPHENETHYL ALCOHOL | A | 1OWZ | 0.72 | |
SOA | ISATOIC ANHYDRIDE | A | 1BIO | 0.75 | |
LOB | LOBELINE | A,B,C,D,E,F, G,H,I,J | 2BYS | 0.72 | |
GB1 | (2R,3R,4S)-2-({[(1R)-2-HYDROXY- 1-PHENYLETHYL]AMINO}METHYL)PYRROLIDINE- 3,4-DIOL | A | 2F18 | 0.76 | |
OBZ | O-benzylhydroxylamine | A,B | 3DTH | 0.73 | |
OBZ | O-benzylhydroxylamine | A,B | 3DTG | 0.73 | |
AEH | 4-(2-aminoethyl)-2-ethylphenol | A | 3BUG | 0.79 | |
PHK | (2R,3S)-3-AMINO-1-CHLORO-4-PHENYL- BUTAN-2-OL | A | 1MU0 | 0.76 | |
PHK | (2R,3S)-3-AMINO-1-CHLORO-4-PHENYL- BUTAN-2-OL | A | 1XRL | 0.76 | |
SK3 | (1R,2R,3S,4S,5R)-5-(BENZYLAMINO)CYCLOPENTANE- 1,2,3,4-TETROL | A | 2F7R | 0.7 | |
ZHH | 2-(4-METHOXYPHENYL)ETHANAMINE | D,H | 2HKR | 0.72 | |
IOB | 3-IODO-BENZYL ALCOHOL | A,B | 1QK0 | 0.74 | |
B3Y | (3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACID | A | 3HF0 | 0.71 | |
B3Y | (3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACID | A | 2OXK | 0.71 | |
B3Y | (3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACID | A,B,C | 2OXJ | 0.71 | |
COR | 2,4-DIAMINO-1,5-DIPHENYL-3-HYDROXYPENTANE | A | 9HVP | 0.76 | |
GB3 | (2R,3R,4S,5R)-2-({[(1R)-2-HYDROXY- 1-PHENYLETHYL]AMINO}METHYL)-5-METHYLPYRROLIDINE- 3,4-DIOL | A | 2F1B | 0.77 | |
SS1 | 1-PHENYLETHANOL | H | 1UM5 | 0.83 | |
2LP | 2-ALLYLPHENOL | A | 1OV5 | 0.7 | |
TTL | TRANS-(1S,2S)-2-AMINO-1,2,3,4-TETRAHYDRONAPHTHALEN- 1-OL | A,B | 2AN5 | 0.83 | |
PR0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B,I | 1ZSF | 0.83 | |
PR0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A | 1JLD | 0.83 | |
PR0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B | 1IDA | 0.83 | |
PR0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B | 1IDB | 0.83 | |
PR0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B,I | 1Z8C | 0.83 | |
PR0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B,I | 1ZBG | 0.83 | |
PR0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B,I | 1ZPK | 0.83 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG2 | 0.81 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG1 | 0.81 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RH0 | 0.81 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGU | 0.81 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGT | 0.81 | |
GB2 | (2R,3R,4S)-2-({[(1S)-2-HYDROXY- 1-PHENYLETHYL]AMINO}METHYL)PYRROLIDINE- 3,4-DIOL | A | 2F1A | 0.76 | |
TYB | TYROSINAL | A,B | 1KDZ | 0.73 | |
TYB | TYROSINAL | A | 1Q11 | 0.73 | |
TYB | TYROSINAL | A,B | 2J5B | 0.73 | |
TYB | TYROSINAL | A,I | 1GA4 | 0.73 | |
TYB | TYROSINAL | A,B,C | 1NLU | 0.73 | |
TYB | TYROSINAL | A,B | 1KE1 | 0.73 | |
TYB | TYROSINAL | A,B | 1H3F | 0.73 | |
TYB | TYROSINAL | A,B | 1H3E | 0.73 | |
MFD | (2S,3S,8S,9S)-3-AMINO-9-METHOXY- 2,6,8-TRIMETHYL-10-PHENYLDECA-4,6- DIENOIC ACID | A | 1AY3 | 0.73 | |
PS0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | A,B,I | 1ZSR | 0.83 | |
PS0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | I | 1ZJ7 | 0.83 | |
PS0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | I | 1ZLF | 0.83 | |
PS0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | I | 1HEG | 0.83 | |
PS0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | I | 1FQX | 0.83 | |
PS0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | A,B,I | 1IIQ | 0.83 | |
PS0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | I | 1HEF | 0.83 | |
959 | benzyl (2-oxopropyl)carbamate | A | 3D62 | 0.74 | |
AED | 4-(2-aminoethyl)-2-cyclohexylphenol | A | 3BUH | 0.75 | |
RSO | R-STYRENE OXIDE | A,B | 1PWZ | 0.71 | |
4BA | 4-[(2-CARBOXY-ETHYLAMINO)-METHYL]- BENZOIC ACID | C | 1FAV | 0.71 | |
TYC | L-TYROSINAMIDE | A | 2BF9 | 0.7 | |
TYC | L-TYROSINAMIDE | A | 2OCI | 0.7 | |
MN7 | 1-CARBOXY-4-ISOBUTYLAMINOMETHYLBENZENE | N | 1NLO | 0.71 | |
OTR | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGT | 0.81 | |
OTR | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG2 | 0.81 | |
OTR | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 2AN4 | 0.81 |