Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00260484
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 |
MN7![]() | 1-CARBOXY-4-ISOBUTYLAMINOMETHYLBENZENE | N | 1NLO | 0.74 | ![]() |
4BA![]() | 4-[(2-CARBOXY-ETHYLAMINO)-METHYL]- BENZOIC ACID | C | 1FAV | 0.74 | ![]() |
OBZ![]() | O-benzylhydroxylamine | A,B | 3DTH | 0.76 | ![]() |
OBZ![]() | O-benzylhydroxylamine | A,B | 3DTG | 0.76 | ![]() |
BPN![]() | PARANITROBENZYL ALCOHOL | H,L | 1YEG | 0.72 | ![]() |
TA2![]() | (2R,3S)-3-AMINO-3-PHENYLPROPANE- 1,2-DIOL | A,B | 2IFR | 0.82 | ![]() |
COR![]() | 2,4-DIAMINO-1,5-DIPHENYL-3-HYDROXYPENTANE | A | 9HVP | 0.74 | ![]() |
SS1![]() | 1-PHENYLETHANOL | H | 1UM5 | 0.78 | ![]() |
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 | ![]() |
PHK![]() | (2R,3S)-3-AMINO-1-CHLORO-4-PHENYL- BUTAN-2-OL | A | 1MU0 | 0.74 | ![]() |
PHK![]() | (2R,3S)-3-AMINO-1-CHLORO-4-PHENYL- BUTAN-2-OL | A | 1XRL | 0.74 | ![]() |
341![]() | (3,5-difluorophenyl)methanol | C | 3EON | 0.75 | ![]() |
HPH![]() | PHENYLALANINDIOL | I | 1E5O | 0.78 | ![]() |
HPH![]() | PHENYLALANINDIOL | A,B | 1ODX | 0.78 | ![]() |
HPH![]() | PHENYLALANINDIOL | A,B | 1MTB | 0.78 | ![]() |
HPH![]() | PHENYLALANINDIOL | A,B | 2FGV | 0.78 | ![]() |
HPH![]() | PHENYLALANINDIOL | A | 1ODW | 0.78 | ![]() |
HPH![]() | PHENYLALANINDIOL | A,B | 2FGU | 0.78 | ![]() |
HPH![]() | PHENYLALANINDIOL | A,B | 1HXB | 0.78 | ![]() |
SBZ![]() | [4-(1,3,2-DIOXABOROLAN-2-YLOXY)METHYL]BENZAMIDINE | A | 1S85 | 0.78 | ![]() |
AEF![]() | 4-(2-aminoethyl)phenol | A | 3BRA | 0.79 | ![]() |
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 | ![]() |
TRJ![]() | META-DI(AMINOMETHYL)BENZENE | A,I | 1GVV | 0.73 | ![]() |
TRJ![]() | META-DI(AMINOMETHYL)BENZENE | A | 1FQ5 | 0.73 | ![]() |
DFB![]() | 2,3-DIFLUOROBENZYL ALCOHOL | A,B | 1QV7 | 0.76 | ![]() |
DFB![]() | 2,3-DIFLUOROBENZYL ALCOHOL | A,B,C,D | 1MG0 | 0.76 | ![]() |
AEH![]() | 4-(2-aminoethyl)-2-ethylphenol | A | 3BUG | 0.77 | ![]() |
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 | ![]() |
HV7![]() | 1-METHYLAMINE-2-HYDROXY-4-METHOXY- BENZENE | C | 1A8G | 0.71 | ![]() |
NDH![]() | (1R, 2S)-CIS 1,2 DIHYDROXY-1,2- DIHYDRONAPHTHALENE | A,B | 1O7P | 0.72 | ![]() |
SOA![]() | ISATOIC ANHYDRIDE | A | 1BIO | 0.81 | ![]() |
2NA![]() | naphthalen-2-ylmethanol | A,B,C | 3EE5 | 0.74 | ![]() |
PDH![]() | (2S)-2-AMINO-3-PHENYL-1-PROPANOL | A | 1GQ0 | 0.82 | ![]() |
PEA![]() | 2-PHENYLETHYLAMINE | A,B,E,F,G,H | 1MHW | 0.7 | ![]() |
PEA![]() | 2-PHENYLETHYLAMINE | A | 1TNJ | 0.7 | ![]() |
PEA![]() | 2-PHENYLETHYLAMINE | D,H | 2HKM | 0.7 | ![]() |
PEA![]() | 2-PHENYLETHYLAMINE | A | 1UTO | 0.7 | ![]() |
PEA![]() | 2-PHENYLETHYLAMINE | A,B | 1D6Y | 0.7 | ![]() |
PEA![]() | 2-PHENYLETHYLAMINE | A,B | 1D6Z | 0.7 | ![]() |
PEA![]() | 2-PHENYLETHYLAMINE | A,B | 1D6U | 0.7 | ![]() |
PEA![]() | 2-PHENYLETHYLAMINE | A | 1UTM | 0.7 | ![]() |
BRB![]() | PARA-BROMOBENZYL ALCOHOL | A,B | 1HLD | 0.71 | ![]() |
ALE![]() | L-EPINEPHRINE | A | 3PAH | 0.7 | ![]() |
ALE![]() | L-EPINEPHRINE | A | 2HKK | 0.7 | ![]() |
BGG![]() | CARBONIC ACID MONOBENZYL ESTER | B,D | 1DLK | 0.7 | ![]() |
1PA![]() | PHENYLMETHYLACETIC ACID ALANINE | I | 1BHF | 0.7 | ![]() |
PG9![]() | D-PHENYLGLYCINE | A,B,G,H | 10GS | 0.74 | ![]() |
PG9![]() | D-PHENYLGLYCINE | A,B,C,D | 2B4K | 0.74 | ![]() |
PHL![]() | L-PHENYLALANINOL | A,B | 1JOH | 0.82 | ![]() |
PHL![]() | L-PHENYLALANINOL | I | 3APR | 0.82 | ![]() |
PHL![]() | L-PHENYLALANINOL | A | 1DLZ | 0.82 | ![]() |
PHL![]() | L-PHENYLALANINOL | A | 1IH9 | 0.82 | ![]() |
PHL![]() | L-PHENYLALANINOL | A | 1OB4 | 0.82 | ![]() |
PHL![]() | L-PHENYLALANINOL | I | 2ER6 | 0.82 | ![]() |
PHL![]() | L-PHENYLALANINOL | A | 1R9U | 0.82 | ![]() |
PHL![]() | L-PHENYLALANINOL | A | 1OB7 | 0.82 | ![]() |
PHL![]() | L-PHENYLALANINOL | A,B | 1OB6 | 0.82 | ![]() |
PHL![]() | L-PHENYLALANINOL | A,B,C | 1AMT | 0.82 | ![]() |
4BZ![]() | 4-(HYDROXYMETHYL)BENZAMIDINE | A | 1S6H | 0.87 | ![]() |
FBA![]() | 4-FLUOROBENZYLAMINE | B,D,E | 1AFQ | 0.71 | ![]() |
FBA![]() | 4-FLUOROBENZYLAMINE | A | 1TNH | 0.71 | ![]() |
269![]() | (1R)-3-chloro-1-phenylpropan-1- ol | A | 2RBS | 0.73 | ![]() |
IOB![]() | 3-IODO-BENZYL ALCOHOL | A,B | 1QK0 | 0.77 | ![]() |
MAZ![]() | FORMIC ACID 3-AMINO-BENZYL ESTER | H,L | 1JYQ | 0.7 | ![]() |
RHP![]() | (3R)-3-(PROP-2-YNYLAMINO)INDAN- 5-OL | A,B | 1S3E | 0.71 | ![]() |
LNR![]() | L-NOREPINEPHRINE | A,B | 2QEO | 0.74 | ![]() |
LNR![]() | L-NOREPINEPHRINE | A | 3DYE | 0.74 | ![]() |
LNR![]() | L-NOREPINEPHRINE | A | 4PAH | 0.74 | ![]() |
MNN![]() | (S)-MANDELIC ACID NITRILE | A | 1YB6 | 0.77 | ![]() |
CTL![]() | CIS-(1R,2S)-2-AMINO-1,2,3,4-TETRAHYDRONAPHTHALEN- 1-OL | A,B | 2AN3 | 0.83 | ![]() |
SAF![]() | 3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL | A | 1GQR | 0.75 | ![]() |
SAF![]() | 3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL | A | 1GQS | 0.75 | ![]() |
MCG![]() | (S)-(ALPHA)-METHYL-4-CARBOXYPHENYLGLYCINE | A,B | 1ISS | 0.71 | ![]() |
PPP![]() | 3-PHENYL-1,2-PROPANDIOL | A,B | 1HRN | 0.71 | ![]() |
PR0![]() | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B,I | 1ZSF | 0.79 | ![]() |
PR0![]() | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A | 1JLD | 0.79 | ![]() |
PR0![]() | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B | 1IDA | 0.79 | ![]() |
PR0![]() | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B | 1IDB | 0.79 | ![]() |
PR0![]() | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B,I | 1Z8C | 0.79 | ![]() |
PR0![]() | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B,I | 1ZBG | 0.79 | ![]() |
PR0![]() | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B,I | 1ZPK | 0.79 | ![]() |
AHT![]() | 4-(2,5-DIAMINO-5-HYDROXY-PENTYL)- PHENOL | I,T | 1TMB | 0.77 | ![]() |
ABN![]() | BENZYLAMINE | D,H | 2HXC | 0.74 | ![]() |
ABN![]() | BENZYLAMINE | A,I | 1A86 | 0.74 | ![]() |
ABN![]() | BENZYLAMINE | A | 1UTN | 0.74 | ![]() |
ABN![]() | BENZYLAMINE | A | 1N6X | 0.74 | ![]() |
ABN![]() | BENZYLAMINE | A | 2BZA | 0.74 | ![]() |
ABN![]() | BENZYLAMINE | A | 2EUS | 0.74 | ![]() |
ABN![]() | BENZYLAMINE | A | 1N6Y | 0.74 | ![]() |
ABN![]() | BENZYLAMINE | A | 1UTJ | 0.74 | ![]() |
SS2![]() | (1R)-1-PHENYLETHANOL | A | 1ZK0 | 0.78 | ![]() |
SS2![]() | (1R)-1-PHENYLETHANOL | A | 1ZJZ | 0.78 | ![]() |
SS2![]() | (1R)-1-PHENYLETHANOL | A | 1ZJY | 0.78 | ![]() |
PS0![]() | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | A,B,I | 1ZSR | 0.79 | ![]() |
PS0![]() | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | I | 1ZJ7 | 0.79 | ![]() |
PS0![]() | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | I | 1ZLF | 0.79 | ![]() |
PS0![]() | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | I | 1HEG | 0.79 | ![]() |
PS0![]() | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | I | 1FQX | 0.79 | ![]() |
PS0![]() | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | A,B,I | 1IIQ | 0.79 | ![]() |
PS0![]() | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | I | 1HEF | 0.79 | ![]() |
B2F![]() | PHENYLALANINE BORONIC ACID | A,P | 1GBM | 0.71 | ![]() |
B2F![]() | PHENYLALANINE BORONIC ACID | A,P | 1GBD | 0.71 | ![]() |
B2F![]() | PHENYLALANINE BORONIC ACID | A,P | 1P06 | 0.71 | ![]() |
B2F![]() | PHENYLALANINE BORONIC ACID | A,P | 1GBI | 0.71 | ![]() |
B2F![]() | PHENYLALANINE BORONIC ACID | A,P | 8LPR | 0.71 | ![]() |
PZM![]() | 1-(4-METHOXYPHENYL)METHANAMINE | A,D,H | 2HJB | 0.74 | ![]() |
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 | ![]() |
PEL![]() | 2-PHENYL-ETHANOL | A,B | 1I0D | 0.75 | ![]() |
PEL![]() | 2-PHENYL-ETHANOL | D,H | 2I0T | 0.75 | ![]() |
PEL![]() | 2-PHENYL-ETHANOL | A,B | 1HZY | 0.75 | ![]() |
PEL![]() | 2-PHENYL-ETHANOL | A,B | 1I0B | 0.75 | ![]() |
PEL![]() | 2-PHENYL-ETHANOL | A | 1EYW | 0.75 | ![]() |
PEL![]() | 2-PHENYL-ETHANOL | A,B | 1JGM | 0.75 | ![]() |
GB1![]() | (2R,3R,4S)-2-({[(1R)-2-HYDROXY- 1-PHENYLETHYL]AMINO}METHYL)PYRROLIDINE- 3,4-DIOL | A | 2F18 | 0.71 | ![]() |
MXN![]() | (2R)-hydroxy(phenyl)ethanenitrile | A,B | 3GDN | 0.77 | ![]() |
OTR![]() | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGT | 0.79 | ![]() |
OTR![]() | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG2 | 0.79 | ![]() |
OTR![]() | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 2AN4 | 0.79 | ![]() |
RPN![]() | (R)-1-PARA-NITRO-PHENYL-2-AZIDO- ETHANOL | A,B,C,D | 1PX0 | 0.71 | ![]() |
RPN![]() | (R)-1-PARA-NITRO-PHENYL-2-AZIDO- ETHANOL | A,B,C,D | 2ZHM | 0.71 | ![]() |
RPN![]() | (R)-1-PARA-NITRO-PHENYL-2-AZIDO- ETHANOL | A | 2ZHN | 0.71 | ![]() |
AEG![]() | 4-[(2R)-2-aminopropyl]phenol | A | 3BUF | 0.78 | ![]() |
24B![]() | (2,4-DIFLUOROPHENYL)METHANOL | A,B | 1QV6 | 0.76 | ![]() |
4FA![]() | 4-FLUOROPHENETHYL ALCOHOL | A | 1OWZ | 0.73 | ![]() |
GB2![]() | (2R,3R,4S)-2-({[(1S)-2-HYDROXY- 1-PHENYLETHYL]AMINO}METHYL)PYRROLIDINE- 3,4-DIOL | A | 2F1A | 0.71 | ![]() |
TTL![]() | TRANS-(1S,2S)-2-AMINO-1,2,3,4-TETRAHYDRONAPHTHALEN- 1-OL | A,B | 2AN5 | 0.83 | ![]() |
AED![]() | 4-(2-aminoethyl)-2-cyclohexylphenol | A | 3BUH | 0.74 | ![]() |
GHP![]() | 4-HYDROXYPHENYLGLYCINE | A | 1DSR | 0.71 | ![]() |
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 | ![]() |
12M![]() | (2-ETHYLPHENYL)METHANOL | A,B | 2F62 | 0.78 | ![]() |
OTS![]() | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG2 | 0.79 | ![]() |
OTS![]() | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG1 | 0.79 | ![]() |
OTS![]() | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RH0 | 0.79 | ![]() |
OTS![]() | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGU | 0.79 | ![]() |
OTS![]() | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGT | 0.79 | ![]() |
271![]() | N-methyl-1-phenylmethanamine | X | 2RBT | 0.7 | ![]() |
GB3![]() | (2R,3R,4S,5R)-2-({[(1R)-2-HYDROXY- 1-PHENYLETHYL]AMINO}METHYL)-5-METHYLPYRROLIDINE- 3,4-DIOL | A | 2F1B | 0.7 | ![]() |
ZHH![]() | 2-(4-METHOXYPHENYL)ETHANAMINE | D,H | 2HKR | 0.7 | ![]() |
4HL![]() | 4-(HYDRAZINOMETHYL)PHENOL | A,B | 2E2U | 0.76 | ![]() |