Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03532493
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 |
CLK | ALPHA-N-DICHLOROACETYL-P-AMINOPHENYLSERINOL | A | 1GRQ | 0.84 | |
COR | 2,4-DIAMINO-1,5-DIPHENYL-3-HYDROXYPENTANE | A | 9HVP | 0.73 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG2 | 0.75 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG1 | 0.75 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RH0 | 0.75 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGU | 0.75 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGT | 0.75 | |
MAZ | FORMIC ACID 3-AMINO-BENZYL ESTER | H,L | 1JYQ | 0.76 | |
TA2 | (2R,3S)-3-AMINO-3-PHENYLPROPANE- 1,2-DIOL | A,B | 2IFR | 0.8 | |
44B | 1,1,1,3,3,3-HEXAFLUORO-2-{4-[(2,2,2- TRIFLUOROETHYL)AMINO]PHENYL}PROPAN- 2-OL | A,B,C,D | 1PQ9 | 0.79 | |
EAB | (3-{(E)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B | 2H3T | 0.74 | |
OTR | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGT | 0.75 | |
OTR | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG2 | 0.75 | |
OTR | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 2AN4 | 0.75 | |
GAB | 3-AMINOBENZOIC ACID | A,B,C,D,E,F | 2PQF | 0.71 | |
GAB | 3-AMINOBENZOIC ACID | A,B | 3GSB | 0.71 | |
GAB | 3-AMINOBENZOIC ACID | A,B,C | 1GBN | 0.71 | |
GAB | 3-AMINOBENZOIC ACID | A | 3FHB | 0.71 | |
CFQ | 1-(2-nitrophenyl)-2,2,2-trifluoroethyl]- arsenocholine | A,B | 2V97 | 0.71 | |
CFQ | 1-(2-nitrophenyl)-2,2,2-trifluoroethyl]- arsenocholine | A,B | 2V98 | 0.71 | |
CFQ | 1-(2-nitrophenyl)-2,2,2-trifluoroethyl]- arsenocholine | A,B | 2V96 | 0.71 | |
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 | |
CLC | N-ACETYL-P-NITROPHENYLSERINOL | A | 1GRR | 0.83 | |
ZAB | (3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B | 2H3S | 0.74 | |
ZAB | (3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B,C,D | 2H4B | 0.74 | |
TTL | TRANS-(1S,2S)-2-AMINO-1,2,3,4-TETRAHYDRONAPHTHALEN- 1-OL | A,B | 2AN5 | 0.78 | |
CL8 | CHLORAMPHENICOL SUCCINATE | A,B,C,D,E,F | 2JKN | 0.72 | |
RPN | (R)-1-PARA-NITRO-PHENYL-2-AZIDO- ETHANOL | A,B,C,D | 1PX0 | 0.86 | |
RPN | (R)-1-PARA-NITRO-PHENYL-2-AZIDO- ETHANOL | A,B,C,D | 2ZHM | 0.86 | |
RPN | (R)-1-PARA-NITRO-PHENYL-2-AZIDO- ETHANOL | A | 2ZHN | 0.86 | |
AHC | 4-AMINOHYDROCINNAMIC ACID | A,B | 2AY1 | 0.74 | |
HPH | PHENYLALANINDIOL | I | 1E5O | 0.74 | |
HPH | PHENYLALANINDIOL | A,B | 1ODX | 0.74 | |
HPH | PHENYLALANINDIOL | A,B | 1MTB | 0.74 | |
HPH | PHENYLALANINDIOL | A,B | 2FGV | 0.74 | |
HPH | PHENYLALANINDIOL | A | 1ODW | 0.74 | |
HPH | PHENYLALANINDIOL | A,B | 2FGU | 0.74 | |
HPH | PHENYLALANINDIOL | A,B | 1HXB | 0.74 | |
RNO | (R)-PARA-NITROSTYRENE OXIDE | A,B,C,D | 1ZMT | 0.75 | |
NAF | M-(N,N,N-TRIMETHYLAMMONIO)-2,2,2- TRIFLUORO-1,1-DIHYDROXYETHYLBENZENE | A | 1AMN | 0.74 | |
NAF | M-(N,N,N-TRIMETHYLAMMONIO)-2,2,2- TRIFLUORO-1,1-DIHYDROXYETHYLBENZENE | A,B | 2H9Y | 0.74 | |
CLM | CHLORAMPHENICOL | A | 1K01 | 0.78 | |
CLM | CHLORAMPHENICOL | 1,2,4,A,B,C, D,E,J,K,L,M, N,O,P,R,S,T, U,V,Z | 1NJI | 0.78 | |
CLM | CHLORAMPHENICOL | A,B,C,D,E,F | 2JKL | 0.78 | |
CLM | CHLORAMPHENICOL | A | 2XAT | 0.78 | |
CLM | CHLORAMPHENICOL | A | 4CLA | 0.78 | |
CLM | CHLORAMPHENICOL | A | 1CLA | 0.78 | |
CLM | CHLORAMPHENICOL | A,B,C,D,E,F | 1USQ | 0.78 | |
CLM | CHLORAMPHENICOL | A,B,C,D,E,F | 2JKJ | 0.78 | |
CLM | CHLORAMPHENICOL | A,B | 2UXP | 0.78 | |
CLM | CHLORAMPHENICOL | A | 1QHS | 0.78 | |
CLM | CHLORAMPHENICOL | A | 1QHY | 0.78 | |
CLM | CHLORAMPHENICOL | A | 3CLA | 0.78 | |
GB2 | (2R,3R,4S)-2-({[(1S)-2-HYDROXY- 1-PHENYLETHYL]AMINO}METHYL)PYRROLIDINE- 3,4-DIOL | A | 2F1A | 0.72 | |
LNR | L-NOREPINEPHRINE | A,B | 2QEO | 0.71 | |
LNR | L-NOREPINEPHRINE | A | 3DYE | 0.71 | |
LNR | L-NOREPINEPHRINE | A | 4PAH | 0.71 | |
GB3 | (2R,3R,4S,5R)-2-({[(1R)-2-HYDROXY- 1-PHENYLETHYL]AMINO}METHYL)-5-METHYLPYRROLIDINE- 3,4-DIOL | A | 2F1B | 0.71 | |
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 | |
PHK | (2R,3S)-3-AMINO-1-CHLORO-4-PHENYL- BUTAN-2-OL | A | 1MU0 | 0.72 | |
PHK | (2R,3S)-3-AMINO-1-CHLORO-4-PHENYL- BUTAN-2-OL | A | 1XRL | 0.72 | |
1JZ | 1-[4-(hydroxymethyl)phenyl]guanidine | B | 3FVF | 0.78 | |
CTL | CIS-(1R,2S)-2-AMINO-1,2,3,4-TETRAHYDRONAPHTHALEN- 1-OL | A,B | 2AN3 | 0.78 | |
GB1 | (2R,3R,4S)-2-({[(1R)-2-HYDROXY- 1-PHENYLETHYL]AMINO}METHYL)PYRROLIDINE- 3,4-DIOL | A | 2F18 | 0.72 | |
PS0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | A,B,I | 1ZSR | 0.76 | |
PS0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | I | 1ZJ7 | 0.76 | |
PS0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | I | 1ZLF | 0.76 | |
PS0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | I | 1HEG | 0.76 | |
PS0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | I | 1FQX | 0.76 | |
PS0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | A,B,I | 1IIQ | 0.76 | |
PS0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | I | 1HEF | 0.76 | |
TY2 | 3-AMINO-L-TYROSINE | A,B | 2VH3 | 0.76 | |
SNO | (S)-PARA-NITROSTYRENE OXIDE | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 1ZO8 | 0.75 | |
2AC | 2-AMINO-P-CRESOL | H,I | 1A2C | 0.75 | |
2AC | 2-AMINO-P-CRESOL | A | 1L4M | 0.75 | |
4BZ | 4-(HYDROXYMETHYL)BENZAMIDINE | A | 1S6H | 0.71 | |
AZY | 3-AZIDO-L-TYROSINE | A | 2YXN | 0.75 | |
SOA | ISATOIC ANHYDRIDE | A | 1BIO | 0.85 | |
DBP | 1,3-DIAMINOBENZYL PHENYLALANINE | A | 1A85 | 0.71 | |
PAB | 4-AMINOBENZOIC ACID | A | 1PBD | 0.74 | |
PAB | 4-AMINOBENZOIC ACID | B | 2DZA | 0.74 | |
PAB | 4-AMINOBENZOIC ACID | A | 1IUS | 0.74 | |
PAB | 4-AMINOBENZOIC ACID | A | 1IUU | 0.74 | |
PAB | 4-AMINOBENZOIC ACID | A | 1IUT | 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 | |
PR0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B,I | 1ZSF | 0.76 | |
PR0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A | 1JLD | 0.76 | |
PR0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B | 1IDA | 0.76 | |
PR0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B | 1IDB | 0.76 | |
PR0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B,I | 1Z8C | 0.76 | |
PR0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B,I | 1ZBG | 0.76 | |
PR0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B,I | 1ZPK | 0.76 | |
4MB | 4-[(METHYLSULFONYL)AMINO]BENZOIC ACID | A,B | 2HDS | 0.7 | |
HNT | [(3R)-7-NITRO-1,2,3,4-TETRAHYDROISOQUINOLIN- 3-YL]METHANOL | A,B | 2G70 | 0.72 | |
PHL | L-PHENYLALANINOL | A,B | 1JOH | 0.75 | |
PHL | L-PHENYLALANINOL | I | 3APR | 0.75 | |
PHL | L-PHENYLALANINOL | A | 1DLZ | 0.75 | |
PHL | L-PHENYLALANINOL | A | 1IH9 | 0.75 | |
PHL | L-PHENYLALANINOL | A | 1OB4 | 0.75 | |
PHL | L-PHENYLALANINOL | I | 2ER6 | 0.75 | |
PHL | L-PHENYLALANINOL | A | 1R9U | 0.75 | |
PHL | L-PHENYLALANINOL | A | 1OB7 | 0.75 | |
PHL | L-PHENYLALANINOL | A,B | 1OB6 | 0.75 | |
PHL | L-PHENYLALANINOL | A,B,C | 1AMT | 0.75 | |
PPN | PARA-NITROPHENYLALANINE | I | 1YTJ | 0.73 | |
PDH | (2S)-2-AMINO-3-PHENYL-1-PROPANOL | A | 1GQ0 | 0.75 | |
AHT | 4-(2,5-DIAMINO-5-HYDROXY-PENTYL)- PHENOL | I,T | 1TMB | 0.74 | |
GHP | 4-HYDROXYPHENYLGLYCINE | A | 1DSR | 0.71 | |
AEF | 4-(2-aminoethyl)phenol | A | 3BRA | 0.7 | |
AO2 | N'-(2S,3R)-3-AMINO-4-CYCLOHEXYL- 2-HYDROXY-BUTANO-N-(4-METHYLPHENYL)HYDRAZIDE | A | 1R5H | 0.73 | |
BRX | BROMAMPHENICOL | A,B,C,D,E,F | 2JKL | 0.8 | |
AEG | 4-[(2R)-2-aminopropyl]phenol | A | 3BUF | 0.72 | |
M09 | (3S,5R,7R,8S,9S,10R)-7-(hydroxymethyl)- 3-(4-nitrophenyl)-1,6-dioxa-2-azaspiro[4.5]decane- 8,9,10-triol | A | 2QRM | 0.72 | |
BPN | PARANITROBENZYL ALCOHOL | H,L | 1YEG | 0.8 | |
PIR | 2-(4-AMINO-PHENYL)-5-HYDROXYMETHYL- PYRROLIDINE-3,4-DIOL | A,B,C,D | 2MAS | 0.83 |