Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03337018
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 |
KY1 | 4-(2-AMINOPHENYL)-4-OXOBUTANOIC ACID | A,B,C,D | 2CH2 | 0.76 | |
MHB | A,B | 1SRG | 0.82 | ||
OBA | 2-(OXALYL-AMINO)-BENZOIC ACID | A | 1C85 | 0.73 | |
MRE | 2-(4-DIMETHYLAMINOPHENYL)DIAZENYLBENZOIC ACID | A,B | 2V9C | 0.84 | |
878 | 5-IODO-2-(OXALYL-AMINO)-BENZOIC ACID | A | 1ECV | 0.71 | |
ZAB | (3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B | 2H3S | 0.73 | |
ZAB | (3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B,C,D | 2H4B | 0.73 | |
MTB | A,B | 1SRF | 0.78 | ||
OFL | O-TRIFLUOROMETHYLPHENYL ANTHRANILIC ACID | A | 1DVZ | 0.78 | |
ICU | METHYL(2-ACETOXY-2-(2-CARBOXY-4- AMINO-PHENYL))ACETATE | A | 1JIM | 0.73 | |
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 | 0.73 | |
AHC | 4-AMINOHYDROCINNAMIC ACID | A,B | 2AY1 | 0.7 | |
EAB | (3-{(E)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B | 2H3T | 0.73 | |
BZM | BENZOIC ACID PHENYLMETHYLESTER | A,B | 1DZM | 0.77 | |
MNB | 5-MERCAPTO-2-NITRO-BENZOIC ACID | A | 1F42 | 0.74 | |
MNB | 5-MERCAPTO-2-NITRO-BENZOIC ACID | A | 1RXE | 0.74 | |
MNB | 5-MERCAPTO-2-NITRO-BENZOIC ACID | A | 2PER | 0.74 | |
PAB | 4-AMINOBENZOIC ACID | A | 1PBD | 0.76 | |
PAB | 4-AMINOBENZOIC ACID | B | 2DZA | 0.76 | |
PAB | 4-AMINOBENZOIC ACID | A | 1IUS | 0.76 | |
PAB | 4-AMINOBENZOIC ACID | A | 1IUU | 0.76 | |
PAB | 4-AMINOBENZOIC ACID | A | 1IUT | 0.76 | |
R2C | 5-METHOXY-2-[(4-PHENOXYPHENYL)AMINO]BENZOIC ACID | A | 2PRL | 0.72 | |
SX1 | 2-amino-5-bromobenzoic acid | A,B | 3CIZ | 0.76 | |
NAB | A,B | 1SRJ | 0.74 | ||
F77 | 3-ETHYL-6-{[(4-FLUOROPHENYL)SULFONYL]AMINO}- 2-METHYLBENZOIC ACID | A | 2EA2 | 0.72 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D,E,F, G,H | 1F8S | 0.83 | |
BE2 | 2-AMINOBENZOIC ACID | E,I | 1ZFP | 0.83 | |
BE2 | 2-AMINOBENZOIC ACID | A,B | 2HU8 | 0.83 | |
BE2 | 2-AMINOBENZOIC ACID | A,B | 1AN9 | 0.83 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D | 2GVQ | 0.83 | |
BE2 | 2-AMINOBENZOIC ACID | A,B | 2YR6 | 0.83 | |
BE2 | 2-AMINOBENZOIC ACID | A,I | 1E8N | 0.83 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D | 1ZYK | 0.83 | |
BE2 | 2-AMINOBENZOIC ACID | A | 1C0I | 0.83 | |
BE2 | 2-AMINOBENZOIC ACID | A,B | 2JB3 | 0.83 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D | 2E4A | 0.83 | |
RAC | 4-(2-DIMETHYLCARBAMOYL-PHENYLCARBAMOYLOXYMETHYL)- BENZOIC ACID | H | 1MEX | 0.78 | |
794 | 2-[(CARBOXYCARBONYL)(1-NAPHTHYL)AMINO]BENZOIC ACID | A | 1NO6 | 0.71 | |
MOB | A,B | 1SRH | 0.75 | ||
3HA | 3-HYDROXYANTHRANILIC ACID | A,B | 1U1W | 0.72 | |
3HA | 3-HYDROXYANTHRANILIC ACID | A | 1YFY | 0.72 | |
XP1 | 4-(DIMETHYLAMINO)BENZOIC ACID | A,B | 2VJ1 | 0.74 | |
XP1 | 4-(DIMETHYLAMINO)BENZOIC ACID | A | 2V6N | 0.74 | |
A41 | 5-METHYL-2-[(PHENYLSULFONYL)AMINO]BENZOIC ACID | A | 1YW7 | 0.77 | |
GAB | 3-AMINOBENZOIC ACID | A,B,C,D,E,F | 2PQF | 0.77 | |
GAB | 3-AMINOBENZOIC ACID | A,B | 3GSB | 0.77 | |
GAB | 3-AMINOBENZOIC ACID | A,B,C | 1GBN | 0.77 | |
GAB | 3-AMINOBENZOIC ACID | A | 3FHB | 0.77 | |
D27 | 2-{[(2E)-3-(3,4-dimethoxyphenyl)prop- 2-enoyl]amino}benzoic acid | A,B,C,D | 2VD0 | 0.72 | |
HAB | A,B | 1SRE | 0.83 | ||
MAZ | FORMIC ACID 3-AMINO-BENZYL ESTER | H,L | 1JYQ | 0.75 | |
UC3 | 1-METHYL ETHYL 2-CHLORO-5-[[[(1- METHYLETHOXY)THIOOXO]METHYL]AMINO]- BENZOATE | A | 1RT6 | 0.71 | |
DMB | A,B | 1SRI | 0.82 | ||
TYZ | PARA ACETAMIDO BENZOIC ACID | B,C | 2BNI | 0.71 | |
TYZ | PARA ACETAMIDO BENZOIC ACID | A | 1W5K | 0.71 | |
TYZ | PARA ACETAMIDO BENZOIC ACID | A | 1W5J | 0.71 | |
KYN | KYNURENINE | A,B,C,D | 2R2N | 0.73 | |
KYN | KYNURENINE | A,B | 3E2Z | 0.73 | |
KYN | KYNURENINE | A | 1XT7 | 0.73 | |
KYN | KYNURENINE | A | 1T5M | 0.73 | |
KYN | KYNURENINE | A | 1T5N | 0.73 | |
KYN | KYNURENINE | A | 2VOV | 0.73 | |
KYN | KYNURENINE | A | 2VOX | 0.73 | |
IBR | A | 9EST | 0.74 | ||
A75 | 2-[(PHENYLSULFONYL)AMINO]-5,6,7,8- TETRAHYDRONAPHTHALENE-1-CARBOXYLIC ACID | A | 1YW8 | 0.71 | |
U14 | 3-(5-AMINO-3-IMINO-3H-PYRAZOL-4- YLAZO)-BENZOIC ACID | A | 2GG7 | 0.74 | |
4NB | 4-NITROBENZOIC ACID | A,B | 3CHT | 0.72 | |
FLF | 2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID | A,B | 1BM7 | 0.78 | |
FLF | 2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID | A | 1S2C | 0.78 | |
FLF | 2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID | A | 2PIX | 0.78 | |
4MB | 4-[(METHYLSULFONYL)AMINO]BENZOIC ACID | A,B | 2HDS | 0.73 | |
3B4 | 2-(cyclohexylamino)benzoic acid | A,B | 3B4P | 0.77 |