Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02249320
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 |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | 0,1,3,4,5,9, A,B,C,H,J,K, L,M,N,O,Q,R, S,T,U,Y,Z | 1VQ6 | 0.75 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | A,B | 1C1X | 0.75 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | 0,1,3,4,9,A, B,C,D,F,H,J, K,L,M,N,O,Q, R,S,T,U,Y,Z | 1VQP | 0.75 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | 0,1,2,3,4,5, 9,A,B,C,D,F, H,J,K,L,M,N, O,Q,R,S,T,U, Y,Z | 1VQN | 0.75 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | I | 1QRP | 0.75 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | A | 2CTC | 0.75 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | I | 1E82 | 0.75 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | I | 1E81 | 0.75 | |
GBS | 4-GUANIDINOBENZOIC ACID | X | 2AH4 | 0.71 | |
GBS | 4-GUANIDINOBENZOIC ACID | A | 1GBT | 0.71 | |
GBS | 4-GUANIDINOBENZOIC ACID | A | 1RTK | 0.71 | |
GBS | 4-GUANIDINOBENZOIC ACID | A | 3DFL | 0.71 | |
MNP | 2-(3-NITROPHENYL)ACETIC ACID | B | 1AI5 | 0.79 | |
DIF | 2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID | A,B | 3CFQ | 0.71 | |
DIF | 2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID | A | 1SV9 | 0.71 | |
DIF | 2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID | A | 1NR6 | 0.71 | |
DIF | 2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID | A | 3HWV | 0.71 | |
DIF | 2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID | B | 1DVX | 0.71 | |
DIF | 2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID | A | 2B6D | 0.71 | |
DIF | 2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID | A,B,C,D | 1PXX | 0.71 | |
DIF | 2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID | A | 2B17 | 0.71 | |
TYZ | PARA ACETAMIDO BENZOIC ACID | B,C | 2BNI | 0.73 | |
TYZ | PARA ACETAMIDO BENZOIC ACID | A | 1W5K | 0.73 | |
TYZ | PARA ACETAMIDO BENZOIC ACID | A | 1W5J | 0.73 | |
PIR | 2-(4-AMINO-PHENYL)-5-HYDROXYMETHYL- PYRROLIDINE-3,4-DIOL | A,B,C,D | 2MAS | 0.72 | |
ICU | METHYL(2-ACETOXY-2-(2-CARBOXY-4- AMINO-PHENYL))ACETATE | A | 1JIM | 0.75 | |
GAB | 3-AMINOBENZOIC ACID | A,B,C,D,E,F | 2PQF | 0.76 | |
GAB | 3-AMINOBENZOIC ACID | A,B | 3GSB | 0.76 | |
GAB | 3-AMINOBENZOIC ACID | A,B,C | 1GBN | 0.76 | |
GAB | 3-AMINOBENZOIC ACID | A | 3FHB | 0.76 | |
TY2 | 3-AMINO-L-TYROSINE | A,B | 2VH3 | 0.72 | |
AHC | 4-AMINOHYDROCINNAMIC ACID | A,B | 2AY1 | 0.84 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | A,B,M,N | 1FJM | 0.71 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | A | 1EVA | 0.71 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | A | 1LCM | 0.71 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | A,B,C,D,E,F, G,H | 2NYM | 0.71 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | C,I | 2IE3 | 0.71 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | C,F,X,Y | 2NPP | 0.71 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | A | 1EVC | 0.71 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | C,F,G,H | 3DW8 | 0.71 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | A,B,C,D,E,F, G,H | 2NYL | 0.71 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | A | 1EVD | 0.71 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | A | 1EVB | 0.71 | |
BHA | 2-HYDROXY-4-AMINOBENZOIC ACID | A | 1PBC | 0.7 | |
BHA | 2-HYDROXY-4-AMINOBENZOIC ACID | A | 1PBF | 0.7 | |
BHA | 2-HYDROXY-4-AMINOBENZOIC ACID | A | 1SXK | 0.7 | |
PG9 | D-PHENYLGLYCINE | A,B,G,H | 10GS | 0.73 | |
PG9 | D-PHENYLGLYCINE | A,B,C,D | 2B4K | 0.73 | |
L98 | (2R)-2-(3-{[AMINO(IMINO)METHYL]AMINO}PHENYL)- 3-SULFANYLPROPANOIC ACID | A,B,C | 1ZG8 | 0.72 | |
AAN | 2-(4-NITROPHENYL)ACETIC ACID | B | 1AJN | 0.76 | |
ST5 | 4-(ACETYLAMINO)-3-[(HYDROXYACETYL)AMINO]BENZOIC ACID | A,B | 1ING | 0.72 | |
PAB | 4-AMINOBENZOIC ACID | A | 1PBD | 0.79 | |
PAB | 4-AMINOBENZOIC ACID | B | 2DZA | 0.79 | |
PAB | 4-AMINOBENZOIC ACID | A | 1IUS | 0.79 | |
PAB | 4-AMINOBENZOIC ACID | A | 1IUU | 0.79 | |
PAB | 4-AMINOBENZOIC ACID | A | 1IUT | 0.79 | |
AZY | 3-AZIDO-L-TYROSINE | A | 2YXN | 0.71 | |
RMN | (R)-MANDELIC ACID | A | 1MDL | 0.71 | |
RMN | (R)-MANDELIC ACID | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 1MCZ | 0.71 | |
PRQ | (3S)-3-amino-3-(2-nitrophenyl)propanoic acid | C,F,I,L | 2VE6 | 0.78 | |
KY1 | 4-(2-AMINOPHENYL)-4-OXOBUTANOIC ACID | A,B,C,D | 2CH2 | 0.78 | |
AO2 | N'-(2S,3R)-3-AMINO-4-CYCLOHEXYL- 2-HYDROXY-BUTANO-N-(4-METHYLPHENYL)HYDRAZIDE | A | 1R5H | 0.72 | |
2UN | {4-[2-BENZYL-3-METHOXY-2-(METHOXYCARBONYL)- 3-OXOPROPYL]PHENYL}SULFAMIC ACID | A,B | 2H02 | 0.71 | |
EAB | (3-{(E)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B | 2H3T | 0.82 | |
IBR | A | 9EST | 0.72 | ||
ST3 | 4-(ACETYLAMINO)-3-AMINO BENZOIC ACID | A,B | 1IVE | 0.7 | |
SMN | (S)-MANDELIC ACID | A | 1MDL | 0.71 | |
DPN | D-PHENYLALANINE | P | 1MCS | 0.71 | |
DPN | D-PHENYLALANINE | A | 1GOE | 0.71 | |
DPN | D-PHENYLALANINE | A | 2RM9 | 0.71 | |
DPN | D-PHENYLALANINE | A | 1SOC | 0.71 | |
DPN | D-PHENYLALANINE | B,C,E,F | 1SFQ | 0.71 | |
DPN | D-PHENYLALANINE | I | 1ABJ | 0.71 | |
DPN | D-PHENYLALANINE | P | 1DWE | 0.71 | |
DPN | D-PHENYLALANINE | I,M | 1HLT | 0.71 | |
DPN | D-PHENYLALANINE | A,H,L | 1J9C | 0.71 | |
DPN | D-PHENYLALANINE | I,T | 1TMB | 0.71 | |
DPN | D-PHENYLALANINE | A | 2JRY | 0.71 | |
DPN | D-PHENYLALANINE | A | 2SOC | 0.71 | |
DPN | D-PHENYLALANINE | A | 2YYF | 0.71 | |
DPN | D-PHENYLALANINE | I | 2HGT | 0.71 | |
DPN | D-PHENYLALANINE | A,D | 2Q3I | 0.71 | |
DPN | D-PHENYLALANINE | A,P | 1MCD | 0.71 | |
DPN | D-PHENYLALANINE | P | 1HAO | 0.71 | |
DPN | D-PHENYLALANINE | A,B,I | 1Z8J | 0.71 | |
DPN | D-PHENYLALANINE | A,B,C | 2PGQ | 0.71 | |
DPN | D-PHENYLALANINE | C,D,H,I,L,M, X,Y | 1DVA | 0.71 | |
DPN | D-PHENYLALANINE | P | 1NRR | 0.71 | |
DPN | D-PHENYLALANINE | I | 1PPB | 0.71 | |
DPN | D-PHENYLALANINE | C,D,G,H | 1NU7 | 0.71 | |
DPN | D-PHENYLALANINE | I | 2HPP | 0.71 | |
DPN | D-PHENYLALANINE | B,C | 2OD3 | 0.71 | |
DPN | D-PHENYLALANINE | A | 1B0Q | 0.71 | |
DPN | D-PHENYLALANINE | B,C,E,F | 1NU9 | 0.71 | |
DPN | D-PHENYLALANINE | A,B,I | 1Z8I | 0.71 | |
DPN | D-PHENYLALANINE | H,I,J | 1TMU | 0.71 | |
DPN | D-PHENYLALANINE | A,B,C,D,E,F | 2DNS | 0.71 | |
DPN | D-PHENYLALANINE | A | 1GO9 | 0.71 | |
DPN | D-PHENYLALANINE | B,C,E,F | 1A0H | 0.71 | |
DPN | D-PHENYLALANINE | P | 1MCF | 0.71 | |
DPN | D-PHENYLALANINE | A | 2RME | 0.71 | |
DPN | D-PHENYLALANINE | H,I | 1TMT | 0.71 | |
DPN | D-PHENYLALANINE | I | 1ABI | 0.71 | |
DPN | D-PHENYLALANINE | R | 1NRQ | 0.71 | |
DPN | D-PHENYLALANINE | B,C,F,G | 2A1D | 0.71 | |
DPN | D-PHENYLALANINE | A,B | 2Q33 | 0.71 | |
DPN | D-PHENYLALANINE | C,H,L | 1DAN | 0.71 | |
DPN | D-PHENYLALANINE | P | 1MCE | 0.71 | |
DPN | D-PHENYLALANINE | B,C,E,F | 2A45 | 0.71 | |
DPN | D-PHENYLALANINE | A | 2RMI | 0.71 | |
DPN | D-PHENYLALANINE | A,B,I | 1TQ7 | 0.71 | |
DPN | D-PHENYLALANINE | A | 1W7M | 0.71 | |
DPN | D-PHENYLALANINE | P | 1HAP | 0.71 | |
DPN | D-PHENYLALANINE | A,B | 1ORF | 0.71 | |
DPN | D-PHENYLALANINE | I | 1IHS | 0.71 | |
DPN | D-PHENYLALANINE | P | 1MCC | 0.71 | |
DPN | D-PHENYLALANINE | A | 2RMD | 0.71 | |
DPN | D-PHENYLALANINE | A | 2JQB | 0.71 | |
DPN | D-PHENYLALANINE | I | 2HPQ | 0.71 | |
DPN | D-PHENYLALANINE | C,E,F | 1SHH | 0.71 | |
DPN | D-PHENYLALANINE | A,I | 1CVR | 0.71 | |
DPN | D-PHENYLALANINE | L,P | 1AUT | 0.71 | |
DPN | D-PHENYLALANINE | P | 1MCI | 0.71 | |
DPN | D-PHENYLALANINE | H,I | 3F6U | 0.71 | |
DPN | D-PHENYLALANINE | A | 1BFW | 0.71 | |
DPN | D-PHENYLALANINE | H,I | 1HAI | 0.71 | |
DPN | D-PHENYLALANINE | B,C | 2THF | 0.71 | |
DPN | D-PHENYLALANINE | I | 1IHT | 0.71 | |
DPN | D-PHENYLALANINE | A,P | 1MCJ | 0.71 | |
DPN | D-PHENYLALANINE | A | 1TKH | 0.71 | |
DPN | D-PHENYLALANINE | C,H,L,T | 2FIR | 0.71 | |
DPN | D-PHENYLALANINE | A | 2FMZ | 0.71 | |
DPN | D-PHENYLALANINE | A | 1YL9 | 0.71 | |
DPN | D-PHENYLALANINE | I | 1HUT | 0.71 | |
DPN | D-PHENYLALANINE | I | 1FXY | 0.71 | |
DPN | D-PHENYLALANINE | A | 1YL8 | 0.71 | |
DPN | D-PHENYLALANINE | C,H,L | 1QFK | 0.71 | |
DPN | D-PHENYLALANINE | P | 1MCB | 0.71 | |
SOA | ISATOIC ANHYDRIDE | A | 1BIO | 0.75 | |
ZAB | (3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B | 2H3S | 0.82 | |
ZAB | (3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B,C,D | 2H4B | 0.82 | |
OPH | 2-HYDROXY-3-PHENYL-PROPIONIC ACID METHYL ESTER | E,I | 1PPM | 0.73 | |
OPH | 2-HYDROXY-3-PHENYL-PROPIONIC ACID METHYL ESTER | E,I | 1PPL | 0.73 | |
XP1 | 4-(DIMETHYLAMINO)BENZOIC ACID | A,B | 2VJ1 | 0.72 | |
XP1 | 4-(DIMETHYLAMINO)BENZOIC ACID | A | 2V6N | 0.72 | |
MAZ | FORMIC ACID 3-AMINO-BENZYL ESTER | H,L | 1JYQ | 0.73 | |
FOG | (4S,5S)-5-amino-4-hydroxy-6-phenylhexanoic acid | I | 1EED | 0.76 | |
TA2 | (2R,3S)-3-AMINO-3-PHENYLPROPANE- 1,2-DIOL | A,B | 2IFR | 0.72 | |
4NB | 4-NITROBENZOIC ACID | A,B | 3CHT | 0.72 | |
PSA | 3-HYDROXY-4-AMINO-5-PHENYLPENTANOIC ACID | I | 1EPL | 0.73 | |
PSA | 3-HYDROXY-4-AMINO-5-PHENYLPENTANOIC ACID | A,B,C,D | 2IFW | 0.73 | |
PSA | 3-HYDROXY-4-AMINO-5-PHENYLPENTANOIC ACID | E,I | 1EPM | 0.73 | |
KYN | KYNURENINE | A,B,C,D | 2R2N | 0.74 | |
KYN | KYNURENINE | A,B | 3E2Z | 0.74 | |
KYN | KYNURENINE | A | 1XT7 | 0.74 | |
KYN | KYNURENINE | A | 1T5M | 0.74 | |
KYN | KYNURENINE | A | 1T5N | 0.74 | |
KYN | KYNURENINE | A | 2VOV | 0.74 | |
KYN | KYNURENINE | A | 2VOX | 0.74 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D,E,F, G,H | 1F8S | 0.75 | |
BE2 | 2-AMINOBENZOIC ACID | E,I | 1ZFP | 0.75 | |
BE2 | 2-AMINOBENZOIC ACID | A,B | 2HU8 | 0.75 | |
BE2 | 2-AMINOBENZOIC ACID | A,B | 1AN9 | 0.75 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D | 2GVQ | 0.75 | |
BE2 | 2-AMINOBENZOIC ACID | A,B | 2YR6 | 0.75 | |
BE2 | 2-AMINOBENZOIC ACID | A,I | 1E8N | 0.75 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D | 1ZYK | 0.75 | |
BE2 | 2-AMINOBENZOIC ACID | A | 1C0I | 0.75 | |
BE2 | 2-AMINOBENZOIC ACID | A,B | 2JB3 | 0.75 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D | 2E4A | 0.75 | |
4MB | 4-[(METHYLSULFONYL)AMINO]BENZOIC ACID | A,B | 2HDS | 0.75 | |
4A3 | 4-AMINO-3-HYDROXYBENZOIC ACID | A,B | 2HDR | 0.71 | |
PPN | PARA-NITROPHENYLALANINE | I | 1YTJ | 0.74 |