Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02229658
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 |
TY2 | 3-AMINO-L-TYROSINE | A,B | 2VH3 | 0.7 | |
KY1 | 4-(2-AMINOPHENYL)-4-OXOBUTANOIC ACID | A,B,C,D | 2CH2 | 0.76 | |
HAB | A,B | 1SRE | 0.73 | ||
878 | 5-IODO-2-(OXALYL-AMINO)-BENZOIC ACID | A | 1ECV | 0.71 | |
4MB | 4-[(METHYLSULFONYL)AMINO]BENZOIC ACID | A,B | 2HDS | 0.79 | |
RAC | 4-(2-DIMETHYLCARBAMOYL-PHENYLCARBAMOYLOXYMETHYL)- BENZOIC ACID | H | 1MEX | 0.75 | |
MRE | 2-(4-DIMETHYLAMINOPHENYL)DIAZENYLBENZOIC ACID | A,B | 2V9C | 0.73 | |
ST5 | 4-(ACETYLAMINO)-3-[(HYDROXYACETYL)AMINO]BENZOIC ACID | A,B | 1ING | 0.74 | |
ST3 | 4-(ACETYLAMINO)-3-AMINO BENZOIC ACID | A,B | 1IVE | 0.76 | |
MN7 | 1-CARBOXY-4-ISOBUTYLAMINOMETHYLBENZENE | N | 1NLO | 0.73 | |
BZM | BENZOIC ACID PHENYLMETHYLESTER | A,B | 1DZM | 0.75 | |
PAB | 4-AMINOBENZOIC ACID | A | 1PBD | 0.82 | |
PAB | 4-AMINOBENZOIC ACID | B | 2DZA | 0.82 | |
PAB | 4-AMINOBENZOIC ACID | A | 1IUS | 0.82 | |
PAB | 4-AMINOBENZOIC ACID | A | 1IUU | 0.82 | |
PAB | 4-AMINOBENZOIC ACID | A | 1IUT | 0.82 | |
U14 | 3-(5-AMINO-3-IMINO-3H-PYRAZOL-4- YLAZO)-BENZOIC ACID | A | 2GG7 | 0.79 | |
GAB | 3-AMINOBENZOIC ACID | A,B,C,D,E,F | 2PQF | 0.88 | |
GAB | 3-AMINOBENZOIC ACID | A,B | 3GSB | 0.88 | |
GAB | 3-AMINOBENZOIC ACID | A,B,C | 1GBN | 0.88 | |
GAB | 3-AMINOBENZOIC ACID | A | 3FHB | 0.88 | |
GIS | ETHYL-(2-CARBOXY-4-GUANIDINIUM- PHENYL)-CHLOROACETATE | E | 8EST | 0.72 | |
4A3 | 4-AMINO-3-HYDROXYBENZOIC ACID | A,B | 2HDR | 0.72 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D,E,F, G,H | 1F8S | 0.82 | |
BE2 | 2-AMINOBENZOIC ACID | E,I | 1ZFP | 0.82 | |
BE2 | 2-AMINOBENZOIC ACID | A,B | 2HU8 | 0.82 | |
BE2 | 2-AMINOBENZOIC ACID | A,B | 1AN9 | 0.82 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D | 2GVQ | 0.82 | |
BE2 | 2-AMINOBENZOIC ACID | A,B | 2YR6 | 0.82 | |
BE2 | 2-AMINOBENZOIC ACID | A,I | 1E8N | 0.82 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D | 1ZYK | 0.82 | |
BE2 | 2-AMINOBENZOIC ACID | A | 1C0I | 0.82 | |
BE2 | 2-AMINOBENZOIC ACID | A,B | 2JB3 | 0.82 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D | 2E4A | 0.82 | |
IDB | 3-[5-[(3-CARBOXY-2,4,6-TRIIODO- PHENYL)CARBAMOYL]PENTANOYLAMINO]- 2,4,6-TRIIODO-BENZOIC ACID | A | 2BXN | 0.72 | |
ST6 | 4-(ACETYLAMINO)-3-[(AMINOACETYL)AMINO]BENZOIC ACID | A,B | 1INH | 0.73 | |
UC4 | 1-METHYL ETHYL 1-CHLORO-5-[[(5,6DIHYDRO- 2-METHYL-1,4-OXATHIIN-3-YL)CARBONYL]AMINO]BENZOATE | A | 1RT7 | 0.75 | |
FDI | 4-(N-ACETYLAMINO)-3-[N-(2-ETHYLBUTANOYLAMINO)]BENZOIC ACID | A | 1B9S | 0.76 | |
I3C | 5-amino-2,4,6-triiodobenzene-1,3- dicarboxylic acid | A | 3GT4 | 0.72 | |
I3C | 5-amino-2,4,6-triiodobenzene-1,3- dicarboxylic acid | A | 3E3T | 0.72 | |
I3C | 5-amino-2,4,6-triiodobenzene-1,3- dicarboxylic acid | A | 3E3D | 0.72 | |
I3C | 5-amino-2,4,6-triiodobenzene-1,3- dicarboxylic acid | A | 3E3S | 0.72 | |
I3C | 5-amino-2,4,6-triiodobenzene-1,3- dicarboxylic acid | A | 3E79 | 0.72 | |
EAB | (3-{(E)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B | 2H3T | 0.72 | |
OFL | O-TRIFLUOROMETHYLPHENYL ANTHRANILIC ACID | A | 1DVZ | 0.74 | |
DMB | A,B | 1SRI | 0.73 | ||
ST4 | 4-(ACETYLAMINO)-3-GUANIDINOBENZOIC ACID | A | 1INF | 0.72 | |
OBA | 2-(OXALYL-AMINO)-BENZOIC ACID | A | 1C85 | 0.72 | |
MCG | (S)-(ALPHA)-METHYL-4-CARBOXYPHENYLGLYCINE | A,B | 1ISS | 0.74 | |
F77 | 3-ETHYL-6-{[(4-FLUOROPHENYL)SULFONYL]AMINO}- 2-METHYLBENZOIC ACID | A | 2EA2 | 0.7 | |
XP1 | 4-(DIMETHYLAMINO)BENZOIC ACID | A,B | 2VJ1 | 0.76 | |
XP1 | 4-(DIMETHYLAMINO)BENZOIC ACID | A | 2V6N | 0.76 | |
R2C | 5-METHOXY-2-[(4-PHENOXYPHENYL)AMINO]BENZOIC ACID | A | 2PRL | 0.7 | |
4BA | 4-[(2-CARBOXY-ETHYLAMINO)-METHYL]- BENZOIC ACID | C | 1FAV | 0.7 | |
TYZ | PARA ACETAMIDO BENZOIC ACID | B,C | 2BNI | 0.77 | |
TYZ | PARA ACETAMIDO BENZOIC ACID | A | 1W5K | 0.77 | |
TYZ | PARA ACETAMIDO BENZOIC ACID | A | 1W5J | 0.77 | |
EOZ | 3,5-BIS[(PHOSPHONOACETYL)AMINO]BENZOIC ACID | A,B,C,D | 2FZK | 0.73 | |
ZAB | (3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B | 2H3S | 0.72 | |
ZAB | (3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B,C,D | 2H4B | 0.72 | |
IBR | A | 9EST | 0.83 | ||
SX1 | 2-amino-5-bromobenzoic acid | A,B | 3CIZ | 0.75 | |
3MB | 3-METHOXYBENZAMIDE | A | 3PAX | 0.72 | |
3B4 | 2-(cyclohexylamino)benzoic acid | A,B | 3B4P | 0.75 | |
MHB | A,B | 1SRG | 0.74 | ||
2UN | {4-[2-BENZYL-3-METHOXY-2-(METHOXYCARBONYL)- 3-OXOPROPYL]PHENYL}SULFAMIC ACID | A,B | 2H02 | 0.71 | |
FLF | 2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID | A,B | 1BM7 | 0.74 | |
FLF | 2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID | A | 1S2C | 0.74 | |
FLF | 2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID | A | 2PIX | 0.74 | |
MCM | 7-AMINO-4-METHYL-CHROMEN-2-ONE | A,B,C,D,I,J, K,L | 3EWF | 0.71 | |
MCM | 7-AMINO-4-METHYL-CHROMEN-2-ONE | A,B,I,L | 2V5W | 0.71 | |
MCM | 7-AMINO-4-METHYL-CHROMEN-2-ONE | B | 1VDN | 0.71 | |
MCM | 7-AMINO-4-METHYL-CHROMEN-2-ONE | C | 1VAI | 0.71 | |
MTB | A,B | 1SRF | 0.71 | ||
ICU | METHYL(2-ACETOXY-2-(2-CARBOXY-4- AMINO-PHENYL))ACETATE | A | 1JIM | 0.82 | |
4NB | 4-NITROBENZOIC ACID | A,B | 3CHT | 0.74 | |
CFQ | 1-(2-nitrophenyl)-2,2,2-trifluoroethyl]- arsenocholine | A,B | 2V97 | 0.7 | |
CFQ | 1-(2-nitrophenyl)-2,2,2-trifluoroethyl]- arsenocholine | A,B | 2V98 | 0.7 | |
CFQ | 1-(2-nitrophenyl)-2,2,2-trifluoroethyl]- arsenocholine | A,B | 2V96 | 0.7 | |
KYN | KYNURENINE | A,B,C,D | 2R2N | 0.72 | |
KYN | KYNURENINE | A,B | 3E2Z | 0.72 | |
KYN | KYNURENINE | A | 1XT7 | 0.72 | |
KYN | KYNURENINE | A | 1T5M | 0.72 | |
KYN | KYNURENINE | A | 1T5N | 0.72 | |
KYN | KYNURENINE | A | 2VOV | 0.72 | |
KYN | KYNURENINE | A | 2VOX | 0.72 | |
3AB | 3-aminobenzamide | A,B,C,D | 3GOY | 0.76 | |
AHC | 4-AMINOHYDROCINNAMIC ACID | A,B | 2AY1 | 0.76 | |
712 | 3-({[(1R)-1-(4-FLUOROPHENYL)ETHYL]AMINO}CARBONYL)- 5-[METHYL(METHYLSULFONYL)AMINO]BENZYL ALPHA- METHYL-D-PHENYLALANINATE | A | 2PH6 | 0.71 | |
SOA | ISATOIC ANHYDRIDE | A | 1BIO | 0.72 | |
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 | |
GBS | 4-GUANIDINOBENZOIC ACID | X | 2AH4 | 0.73 | |
GBS | 4-GUANIDINOBENZOIC ACID | A | 1GBT | 0.73 | |
GBS | 4-GUANIDINOBENZOIC ACID | A | 1RTK | 0.73 | |
GBS | 4-GUANIDINOBENZOIC ACID | A | 3DFL | 0.73 | |
AAN | 2-(4-NITROPHENYL)ACETIC ACID | B | 1AJN | 0.7 | |
UC3 | 1-METHYL ETHYL 2-CHLORO-5-[[[(1- METHYLETHOXY)THIOOXO]METHYL]AMINO]- BENZOATE | A | 1RT6 | 0.81 | |
RXB | (1S)-2-oxo-1-phenyl-2-[(1,3,4-trioxo- 1,2,3,4-tetrahydroisoquinolin-5- yl)amino]ethyl acetate | A,B,C,D | 3DEI | 0.71 | |
MAZ | FORMIC ACID 3-AMINO-BENZYL ESTER | H,L | 1JYQ | 0.84 | |
A41 | 5-METHYL-2-[(PHENYLSULFONYL)AMINO]BENZOIC ACID | A | 1YW7 | 0.73 | |
A80 | N-(5,5,8,8-TETRAMETHYL-5,8-DIHYDRO- NAPHTHALEN-2-YL)-TEREPHTHALAMIC ACID | A | 2CBR | 0.72 |