Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02313297
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 |
2MP![]() | 3,4-DIMETHYLPHENOL | A | 1L5O | 0.72 | ![]() |
BP7![]() | 1,1'-BIPHENYL-3,4-DIOL | A | 2EI0 | 0.75 | ![]() |
DES![]() | DIETHYLSTILBESTROL | A,B,C,D | 1S9P | 0.7 | ![]() |
DES![]() | DIETHYLSTILBESTROL | A,B | 3ERD | 0.7 | ![]() |
DES![]() | DIETHYLSTILBESTROL | A,B | 1TT6 | 0.7 | ![]() |
DES![]() | DIETHYLSTILBESTROL | A,B,C,D | 1TZ8 | 0.7 | ![]() |
ETY![]() | 4-ethylphenol | A,B,C,D | 2RA6 | 0.71 | ![]() |
DAH![]() | 3,4-DIHYDROXYPHENYLALANINE | A,B | 1RNR | 0.75 | ![]() |
DAH![]() | 3,4-DIHYDROXYPHENYLALANINE | A | 6PAH | 0.75 | ![]() |
DAH![]() | 3,4-DIHYDROXYPHENYLALANINE | A,B | 1IVV | 0.75 | ![]() |
AEH![]() | 4-(2-aminoethyl)-2-ethylphenol | A | 3BUG | 0.75 | ![]() |
AED![]() | 4-(2-aminoethyl)-2-cyclohexylphenol | A | 3BUH | 0.71 | ![]() |
TYB![]() | TYROSINAL | A,B | 1KDZ | 0.71 | ![]() |
TYB![]() | TYROSINAL | A | 1Q11 | 0.71 | ![]() |
TYB![]() | TYROSINAL | A,B | 2J5B | 0.71 | ![]() |
TYB![]() | TYROSINAL | A,I | 1GA4 | 0.71 | ![]() |
TYB![]() | TYROSINAL | A,B,C | 1NLU | 0.71 | ![]() |
TYB![]() | TYROSINAL | A,B | 1KE1 | 0.71 | ![]() |
TYB![]() | TYROSINAL | A,B | 1H3F | 0.71 | ![]() |
TYB![]() | TYROSINAL | A,B | 1H3E | 0.71 | ![]() |
HFL![]() | 5-(3,3-DIHYDROXYPROPENY)-3-METHOXY- BENZENE-1,2-DIOL | C,F | 1KYW | 0.7 | ![]() |
HHH![]() | (2S)-hydroxy(4-hydroxyphenyl)ethanoic acid | A,B | 2R5V | 0.71 | ![]() |
PIT![]() | PICEATANNOL | A,B,C,D,E,F, G,H,I,J,K,L, M,N | 2JJ1 | 0.73 | ![]() |
142![]() | CARBIDOPA | A,B | 1JS3 | 0.7 | ![]() |
ECS![]() | 2,3,17BETA-TRIHYDROXY-1,3,5(10)- ESTRATRIENE | A,B,C,D | 2BW7 | 0.71 | ![]() |
EUG![]() | 2-METHOXY-4-VINYL-PHENOL | A | 2QU9 | 0.72 | ![]() |
EUG![]() | 2-METHOXY-4-VINYL-PHENOL | A,B | 1QLU | 0.72 | ![]() |
EUG![]() | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1J | 0.72 | ![]() |
EUG![]() | 2-METHOXY-4-VINYL-PHENOL | A,B | 2VAO | 0.72 | ![]() |
EUG![]() | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1K | 0.72 | ![]() |
EUG![]() | 2-METHOXY-4-VINYL-PHENOL | A,B | 1DZN | 0.72 | ![]() |
EUG![]() | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1L | 0.72 | ![]() |
EUG![]() | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1M | 0.72 | ![]() |
IPB![]() | 5-METHYL-2-(1-METHYLETHYL)PHENOL | A,B | 1E06 | 0.7 | ![]() |
H53![]() | 2-(2,5-DIHYDROXYPHENYL)-6-(HYDROXYMETHYL)OXANE- 3,4,5-TRIOL | A | 2FF5 | 0.72 | ![]() |
H53![]() | 2-(2,5-DIHYDROXYPHENYL)-6-(HYDROXYMETHYL)OXANE- 3,4,5-TRIOL | A | 2FET | 0.72 | ![]() |
LDP![]() | L-DOPAMINE | A,B | 2A3R | 0.84 | ![]() |
LDP![]() | L-DOPAMINE | A | 5PAH | 0.84 | ![]() |
LDP![]() | L-DOPAMINE | A,B | 2QMZ | 0.84 | ![]() |
LDP![]() | L-DOPAMINE | A,B | 2VQ5 | 0.84 | ![]() |
NYS![]() | S-{5-[(1R)-2-amino-1-hydroxyethyl]- 2,3-dihydroxyphenyl}-L-cysteine | B | 2R1V | 0.72 | ![]() |
BPY![]() | BIPHENYL-2,3-DIOL | A | 1KMY | 0.74 | ![]() |
BPY![]() | BIPHENYL-2,3-DIOL | B | 1KW8 | 0.74 | ![]() |
BPY![]() | BIPHENYL-2,3-DIOL | A | 2EI3 | 0.74 | ![]() |
BPY![]() | BIPHENYL-2,3-DIOL | A | 1EIR | 0.74 | ![]() |
BPY![]() | BIPHENYL-2,3-DIOL | B | 1KW6 | 0.74 | ![]() |
BPY![]() | BIPHENYL-2,3-DIOL | B | 1KWC | 0.74 | ![]() |
BPY![]() | BIPHENYL-2,3-DIOL | B | 1KW9 | 0.74 | ![]() |
CMZ![]() | (2S)-1-(2,5-dimethylphenoxy)-3- morpholin-4-ylpropan-2-ol | A | 2OF0 | 0.72 | ![]() |
226![]() | naphthalene-1,2,4,5,7-pentol | A,B | 2NZ5 | 0.7 | ![]() |
ALE![]() | L-EPINEPHRINE | A | 3PAH | 0.95 | ![]() |
ALE![]() | L-EPINEPHRINE | A | 2HKK | 0.95 | ![]() |
Y13![]() | (2E)-3-(3,4-DIHYDROXYPHENYL)-N- [2-(4-HYDROXYPHENYL)ETHYL]ACRYLAMIDE | A | 2EW6 | 0.73 | ![]() |
SAF![]() | 3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL | A | 1GQR | 0.79 | ![]() |
SAF![]() | 3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL | A | 1GQS | 0.79 | ![]() |
OHT![]() | 4-HYDROXYTAMOXIFEN | A | 3ERT | 0.71 | ![]() |
OHT![]() | 4-HYDROXYTAMOXIFEN | A,B | 1S9Q | 0.71 | ![]() |
OHT![]() | 4-HYDROXYTAMOXIFEN | A,B | 1VJB | 0.71 | ![]() |
OHT![]() | 4-HYDROXYTAMOXIFEN | A,B,C,P,R | 2JF9 | 0.71 | ![]() |
OHT![]() | 4-HYDROXYTAMOXIFEN | A,B,C,D,E,F | 2GPV | 0.71 | ![]() |
OHT![]() | 4-HYDROXYTAMOXIFEN | A | 2GPU | 0.71 | ![]() |
OHT![]() | 4-HYDROXYTAMOXIFEN | A | 2P7Z | 0.71 | ![]() |
OHT![]() | 4-HYDROXYTAMOXIFEN | A,B | 2BJ4 | 0.71 | ![]() |
OHT![]() | 4-HYDROXYTAMOXIFEN | A,B | 2FSZ | 0.71 | ![]() |
AEG![]() | 4-[(2R)-2-aminopropyl]phenol | A | 3BUF | 0.75 | ![]() |
OTR![]() | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGT | 0.83 | ![]() |
OTR![]() | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG2 | 0.83 | ![]() |
OTR![]() | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 2AN4 | 0.83 | ![]() |
MCT![]() | 4-METHYLCATECHOL | A | 1L4G | 0.77 | ![]() |
MCT![]() | 4-METHYLCATECHOL | A | 2EHZ | 0.77 | ![]() |
MCT![]() | 4-METHYLCATECHOL | A,B | 1DMH | 0.77 | ![]() |
TXF![]() | (Z)-4-(1-{4-[2-(DIMETHYLAMINO)ETHOXY]PHENYL}- 5-HYDROXY-2-PHENYLPENT-1-ENYL)PHENOL | A,B,C,D,E | 2EWP | 0.72 | ![]() |
OTS![]() | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG2 | 0.83 | ![]() |
OTS![]() | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG1 | 0.83 | ![]() |
OTS![]() | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RH0 | 0.83 | ![]() |
OTS![]() | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGU | 0.83 | ![]() |
OTS![]() | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGT | 0.83 | ![]() |
AEF![]() | 4-(2-aminoethyl)phenol | A | 3BRA | 0.75 | ![]() |
REN![]() | (S)-reticuline | A | 3FWA | 0.71 | ![]() |
REN![]() | (S)-reticuline | A | 3D2D | 0.71 | ![]() |
BM4![]() | 3-[(3R)-3-ethyl-1-{9-[(3S)-3-ethyl- 3-(3-hydroxyphenyl)azepan-1-yl]nonyl}azepan- 3-yl]phenol | X | 2W6C | 0.74 | ![]() |
DHC![]() | CAFFEIC ACID | A,B,C,D,E,F, G,H | 2O7D | 0.71 | ![]() |
DHC![]() | CAFFEIC ACID | A | 1KOU | 0.71 | ![]() |
DHR![]() | (2S)-HYDROXY(4-HYDROXYPHENYL)ETHANENITRILE | A,B | 1E55 | 0.76 | ![]() |
ESL![]() | ESTRIOL | A | 1X8V | 0.7 | ![]() |
E3O![]() | (16ALPHA,17ALPHA)-ESTRA-1,3,5(10)- TRIENE-3,16,17-TRIOL | A | 2J7Y | 0.7 | ![]() |
LNR![]() | L-NOREPINEPHRINE | A,B | 2QEO | 0.91 | ![]() |
LNR![]() | L-NOREPINEPHRINE | A | 3DYE | 0.91 | ![]() |
LNR![]() | L-NOREPINEPHRINE | A | 4PAH | 0.91 | ![]() |
EYK![]() | 2-tert-butylbenzene-1,4-diol | D,F | 3EYM | 0.71 | ![]() |
EYK![]() | 2-tert-butylbenzene-1,4-diol | B | 3EYK | 0.71 | ![]() |
D1N![]() | NAPHTHALENE-1,2-DIOL | A | 2EI1 | 0.72 | ![]() |
G27![]() | (3R,4R,5R)-5-(HYDROXYMETHYL)-1- (3-PHENYLPROPYL)PIPERIDINE-3,4- DIOL | A | 2G9R | 0.7 | ![]() |
G27![]() | (3R,4R,5R)-5-(HYDROXYMETHYL)-1- (3-PHENYLPROPYL)PIPERIDINE-3,4- DIOL | A | 2G9U | 0.7 | ![]() |
MTY![]() | META-TYROSINE | A | 2TOH | 0.71 | ![]() |
MTY![]() | META-TYROSINE | A,B | 1BIQ | 0.71 | ![]() |
MTY![]() | META-TYROSINE | A | 1Q7O | 0.71 | ![]() |
MBD![]() | 3-METHYLCATECHOL | A | 1KNF | 0.76 | ![]() |
MA0![]() | (1R)-6-HYDROXY-N-METHYL-N-[(1Z)- PROP-2-EN-1-YLIDENE]INDAN-1-AMINIUM | A,B | 2C64 | 0.71 | ![]() |
AHT![]() | 4-(2,5-DIAMINO-5-HYDROXY-PENTYL)- PHENOL | I,T | 1TMB | 0.75 | ![]() |
TY3![]() | 3-HYDROXY-L-TYROSINE | A,B | 2VH3 | 0.75 | ![]() |
EPT![]() | HEPTANYL-P-PHENOL | A,B | 1AHZ | 0.71 | ![]() |
DHY![]() | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | M,N,O,P,Q,R | 3PCN | 0.71 | ![]() |
DHY![]() | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | B | 1AI4 | 0.71 | ![]() |
DHY![]() | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | A,B,C,D | 1Q0C | 0.71 | ![]() |
DHY![]() | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | A,B | 1F1V | 0.71 | ![]() |
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 | ![]() |