Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02660032
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 |
4A3 | 4-AMINO-3-HYDROXYBENZOIC ACID | A,B | 2HDR | 0.74 | |
LZQ | 4-[3-(dibenzylamino)phenyl]-2,4- dioxobutanoic acid | A | 3EB1 | 0.79 | |
TYZ | PARA ACETAMIDO BENZOIC ACID | B,C | 2BNI | 0.75 | |
TYZ | PARA ACETAMIDO BENZOIC ACID | A | 1W5K | 0.75 | |
TYZ | PARA ACETAMIDO BENZOIC ACID | A | 1W5J | 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 | |
KYN | KYNURENINE | A,B,C,D | 2R2N | 0.87 | |
KYN | KYNURENINE | A,B | 3E2Z | 0.87 | |
KYN | KYNURENINE | A | 1XT7 | 0.87 | |
KYN | KYNURENINE | A | 1T5M | 0.87 | |
KYN | KYNURENINE | A | 1T5N | 0.87 | |
KYN | KYNURENINE | A | 2VOV | 0.87 | |
KYN | KYNURENINE | A | 2VOX | 0.87 | |
U14 | 3-(5-AMINO-3-IMINO-3H-PYRAZOL-4- YLAZO)-BENZOIC ACID | A | 2GG7 | 0.76 | |
OFL | O-TRIFLUOROMETHYLPHENYL ANTHRANILIC ACID | A | 1DVZ | 0.72 | |
ICU | METHYL(2-ACETOXY-2-(2-CARBOXY-4- AMINO-PHENYL))ACETATE | A | 1JIM | 0.74 | |
PAB | 4-AMINOBENZOIC ACID | A | 1PBD | 0.8 | |
PAB | 4-AMINOBENZOIC ACID | B | 2DZA | 0.8 | |
PAB | 4-AMINOBENZOIC ACID | A | 1IUS | 0.8 | |
PAB | 4-AMINOBENZOIC ACID | A | 1IUU | 0.8 | |
PAB | 4-AMINOBENZOIC ACID | A | 1IUT | 0.8 | |
EOZ | 3,5-BIS[(PHOSPHONOACETYL)AMINO]BENZOIC ACID | A,B,C,D | 2FZK | 0.7 | |
IAM | 4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE | A | 1XY5 | 0.7 | |
IAM | 4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE | A | 1XY8 | 0.7 | |
IAM | 4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE | A | 1XY9 | 0.7 | |
IAM | 4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE | A | 1XXZ | 0.7 | |
IAM | 4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE | A | 1XY4 | 0.7 | |
IAM | 4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE | A | 1XY6 | 0.7 | |
MCG | (S)-(ALPHA)-METHYL-4-CARBOXYPHENYLGLYCINE | A,B | 1ISS | 0.77 | |
3AB | 3-aminobenzamide | A,B,C,D | 3GOY | 0.78 | |
4PH | 4-methyl-L-phenylalanine | B,C | 3BV9 | 0.72 | |
NID | 4-NITRO-INDEN-1-ONE | A,B | 1DOH | 0.72 | |
2UN | {4-[2-BENZYL-3-METHOXY-2-(METHOXYCARBONYL)- 3-OXOPROPYL]PHENYL}SULFAMIC ACID | A,B | 2H02 | 0.73 | |
PRQ | (3S)-3-amino-3-(2-nitrophenyl)propanoic acid | C,F,I,L | 2VE6 | 0.72 | |
MN7 | 1-CARBOXY-4-ISOBUTYLAMINOMETHYLBENZENE | N | 1NLO | 0.72 | |
PBF | PARA-(BENZOYL)-PHENYLALANINE | A | 2FR9 | 0.76 | |
PBF | PARA-(BENZOYL)-PHENYLALANINE | A,B | 1EEN | 0.76 | |
PBF | PARA-(BENZOYL)-PHENYLALANINE | A | 2HGZ | 0.76 | |
PBF | PARA-(BENZOYL)-PHENYLALANINE | A | 2FRB | 0.76 | |
EAB | (3-{(E)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B | 2H3T | 0.77 | |
PG9 | D-PHENYLGLYCINE | A,B,G,H | 10GS | 0.73 | |
PG9 | D-PHENYLGLYCINE | A,B,C,D | 2B4K | 0.73 | |
GF7 | (3S)-1-(4-acetylphenyl)-5-oxopyrrolidine- 3-carboxylic acid | A | 3GQZ | 0.75 | |
OBA | 2-(OXALYL-AMINO)-BENZOIC ACID | A | 1C85 | 0.7 | |
DMB | A,B | 1SRI | 0.73 | ||
AHC | 4-AMINOHYDROCINNAMIC ACID | A,B | 2AY1 | 0.85 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D,E,F, G,H | 1F8S | 0.8 | |
BE2 | 2-AMINOBENZOIC ACID | E,I | 1ZFP | 0.8 | |
BE2 | 2-AMINOBENZOIC ACID | A,B | 2HU8 | 0.8 | |
BE2 | 2-AMINOBENZOIC ACID | A,B | 1AN9 | 0.8 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D | 2GVQ | 0.8 | |
BE2 | 2-AMINOBENZOIC ACID | A,B | 2YR6 | 0.8 | |
BE2 | 2-AMINOBENZOIC ACID | A,I | 1E8N | 0.8 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D | 1ZYK | 0.8 | |
BE2 | 2-AMINOBENZOIC ACID | A | 1C0I | 0.8 | |
BE2 | 2-AMINOBENZOIC ACID | A,B | 2JB3 | 0.8 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D | 2E4A | 0.8 | |
1PA | PHENYLMETHYLACETIC ACID ALANINE | I | 1BHF | 0.7 | |
ZAB | (3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B | 2H3S | 0.77 | |
ZAB | (3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B,C,D | 2H4B | 0.77 | |
3HA | 3-HYDROXYANTHRANILIC ACID | A,B | 1U1W | 0.72 | |
3HA | 3-HYDROXYANTHRANILIC ACID | A | 1YFY | 0.72 | |
TY2 | 3-AMINO-L-TYROSINE | A,B | 2VH3 | 0.71 | |
OSB | 2-SUCCINYLBENZOATE | A | 1FHV | 0.7 | |
OSB | 2-SUCCINYLBENZOATE | A,B,C,D | 1SJB | 0.7 | |
OSB | 2-SUCCINYLBENZOATE | A,B | 2QVH | 0.7 | |
4MB | 4-[(METHYLSULFONYL)AMINO]BENZOIC ACID | A,B | 2HDS | 0.77 | |
FDI | 4-(N-ACETYLAMINO)-3-[N-(2-ETHYLBUTANOYLAMINO)]BENZOIC ACID | A | 1B9S | 0.73 | |
APA | AMIDO PHENYL PYRUVIC ACID | H,I | 1AHT | 0.71 | |
APA | AMIDO PHENYL PYRUVIC ACID | A,B,C,D | 1A0L | 0.71 | |
APA | AMIDO PHENYL PYRUVIC ACID | A | 1TPP | 0.71 | |
B3N | 4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE- N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE | A,B | 3F06 | 0.7 | |
B3N | 4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE- N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE | A,B | 3EZP | 0.7 | |
B3N | 4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE- N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE | A | 3EW8 | 0.7 | |
B3N | 4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE- N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE | A,B | 3EZT | 0.7 | |
B3N | 4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE- N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE | A | 1T67 | 0.7 | |
XP1 | 4-(DIMETHYLAMINO)BENZOIC ACID | A,B | 2VJ1 | 0.74 | |
XP1 | 4-(DIMETHYLAMINO)BENZOIC ACID | A | 2V6N | 0.74 | |
AAN | 2-(4-NITROPHENYL)ACETIC ACID | B | 1AJN | 0.75 | |
MTB | A,B | 1SRF | 0.71 | ||
A80 | N-(5,5,8,8-TETRAMETHYL-5,8-DIHYDRO- NAPHTHALEN-2-YL)-TEREPHTHALAMIC ACID | A | 2CBR | 0.73 | |
ST6 | 4-(ACETYLAMINO)-3-[(AMINOACETYL)AMINO]BENZOIC ACID | A,B | 1INH | 0.71 | |
SX1 | 2-amino-5-bromobenzoic acid | A,B | 3CIZ | 0.73 | |
IBR | A | 9EST | 0.78 | ||
CBL | CHLORAMBUCIL | A,B | 3CSJ | 0.71 | |
TSN | TRICHOSTATIN A | A,B | 1T64 | 0.73 | |
TSN | TRICHOSTATIN A | A,B | 1C3R | 0.73 | |
TSN | TRICHOSTATIN A | A,B,C | 3F0R | 0.73 | |
TSN | TRICHOSTATIN A | A,B,C | 3C10 | 0.73 | |
APD | 3-METHYLPHENYLALANINE | A,B,C | 1GMY | 0.72 | |
TRZ | TRAZEOLIDE | A | 1C12 | 0.7 | |
4AF | 4-ACETYL-L-PHENYLALANINE | A | 1ZH6 | 0.79 | |
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 | |
FLF | 2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID | A,B | 1BM7 | 0.73 | |
FLF | 2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID | A | 1S2C | 0.73 | |
FLF | 2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID | A | 2PIX | 0.73 | |
BHA | 2-HYDROXY-4-AMINOBENZOIC ACID | A | 1PBC | 0.71 | |
BHA | 2-HYDROXY-4-AMINOBENZOIC ACID | A | 1PBF | 0.71 | |
BHA | 2-HYDROXY-4-AMINOBENZOIC ACID | A | 1SXK | 0.71 | |
MHB | A,B | 1SRG | 0.72 | ||
MNP | 2-(3-NITROPHENYL)ACETIC ACID | B | 1AI5 | 0.74 | |
GAB | 3-AMINOBENZOIC ACID | A,B,C,D,E,F | 2PQF | 0.84 | |
GAB | 3-AMINOBENZOIC ACID | A,B | 3GSB | 0.84 | |
GAB | 3-AMINOBENZOIC ACID | A,B,C | 1GBN | 0.84 | |
GAB | 3-AMINOBENZOIC ACID | A | 3FHB | 0.84 | |
ELI | 6-(3-METHYL-1,4-DIOXO-1,4-DIHYDRONAPHTHALEN- 2-YL)HEXANOIC ACID | A,B | 2GH5 | 0.7 | |
HAB | A,B | 1SRE | 0.71 | ||
4NB | 4-NITROBENZOIC ACID | A,B | 3CHT | 0.72 | |
AZY | 3-AZIDO-L-TYROSINE | A | 2YXN | 0.7 | |
KY1 | 4-(2-AMINOPHENYL)-4-OXOBUTANOIC ACID | A,B,C,D | 2CH2 | 0.92 | |
I3C | 5-amino-2,4,6-triiodobenzene-1,3- dicarboxylic acid | A | 3GT4 | 0.71 | |
I3C | 5-amino-2,4,6-triiodobenzene-1,3- dicarboxylic acid | A | 3E3T | 0.71 | |
I3C | 5-amino-2,4,6-triiodobenzene-1,3- dicarboxylic acid | A | 3E3D | 0.71 | |
I3C | 5-amino-2,4,6-triiodobenzene-1,3- dicarboxylic acid | A | 3E3S | 0.71 | |
I3C | 5-amino-2,4,6-triiodobenzene-1,3- dicarboxylic acid | A | 3E79 | 0.71 | |
MRE | 2-(4-DIMETHYLAMINOPHENYL)DIAZENYLBENZOIC ACID | A,B | 2V9C | 0.71 | |
HMF | 2-AMINO-4-PHENYL-BUTYRIC ACID | I,J | 1AY6 | 0.71 | |
3B4 | 2-(cyclohexylamino)benzoic acid | A,B | 3B4P | 0.72 | |
A41 | 5-METHYL-2-[(PHENYLSULFONYL)AMINO]BENZOIC ACID | A | 1YW7 | 0.73 | |
HPE | HOMOPHENYLALANINE | A,B | 1B1H | 0.71 | |
PPN | PARA-NITROPHENYLALANINE | I | 1YTJ | 0.74 | |
ST3 | 4-(ACETYLAMINO)-3-AMINO BENZOIC ACID | A,B | 1IVE | 0.73 |