Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02741823
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 |
DMB | A,B | 1SRI | 0.72 | ||
HAB | A,B | 1SRE | 0.73 | ||
RM2 | 4-HYDROXY-N-PROPARGYL-1(R)-AMINOINDAN | A,B | 2C66 | 0.71 | |
BPY | BIPHENYL-2,3-DIOL | A | 1KMY | 0.78 | |
BPY | BIPHENYL-2,3-DIOL | B | 1KW8 | 0.78 | |
BPY | BIPHENYL-2,3-DIOL | A | 2EI3 | 0.78 | |
BPY | BIPHENYL-2,3-DIOL | A | 1EIR | 0.78 | |
BPY | BIPHENYL-2,3-DIOL | B | 1KW6 | 0.78 | |
BPY | BIPHENYL-2,3-DIOL | B | 1KWC | 0.78 | |
BPY | BIPHENYL-2,3-DIOL | B | 1KW9 | 0.78 | |
DNT | 2-[1-METHYLHEXYL]-4,6-DINITROPHENOL | A,B,C | 1NEN | 0.71 | |
AHT | 4-(2,5-DIAMINO-5-HYDROXY-PENTYL)- PHENOL | I,T | 1TMB | 0.71 | |
A48 | 4-[(DIMESITYLBORYL)(2,2,2-TRIFLUOROETHYL)AMINO]PHENOL | A,B | 2Q6J | 0.72 | |
MTB | A,B | 1SRF | 0.72 | ||
TY2 | 3-AMINO-L-TYROSINE | A,B | 2VH3 | 0.72 | |
4A3 | 4-AMINO-3-HYDROXYBENZOIC ACID | A,B | 2HDR | 0.72 | |
142 | CARBIDOPA | A,B | 1JS3 | 0.7 | |
4NC | 4-NITROCATECHOL | A | 1NO3 | 0.73 | |
4NC | 4-NITROCATECHOL | B | 2BUU | 0.73 | |
4NC | 4-NITROCATECHOL | B | 2BUZ | 0.73 | |
4NC | 4-NITROCATECHOL | B | 1EOC | 0.73 | |
AEG | 4-[(2R)-2-aminopropyl]phenol | A | 3BUF | 0.71 | |
AEH | 4-(2-aminoethyl)-2-ethylphenol | A | 3BUG | 0.72 | |
BP3 | 2'-CHLORO-BIPHENYL-2,3-DIOL | A | 1LGT | 0.72 | |
AB4 | 2,5-DICHLORO-N-[4-HYDROXY-3-(2- HYDROXY-1-NAPHTHYL)PHENYL]BENZENESULFONAMIDE | A,B | 2BZ5 | 0.7 | |
BP7 | 1,1'-BIPHENYL-3,4-DIOL | A | 2EI0 | 0.77 | |
AEF | 4-(2-aminoethyl)phenol | A | 3BRA | 0.71 | |
MBD | 3-METHYLCATECHOL | A | 1KNF | 0.72 | |
AZY | 3-AZIDO-L-TYROSINE | A | 2YXN | 0.71 | |
DAH | 3,4-DIHYDROXYPHENYLALANINE | A,B | 1RNR | 0.72 | |
DAH | 3,4-DIHYDROXYPHENYLALANINE | A | 6PAH | 0.72 | |
DAH | 3,4-DIHYDROXYPHENYLALANINE | A,B | 1IVV | 0.72 | |
ALE | L-EPINEPHRINE | A | 3PAH | 0.7 | |
ALE | L-EPINEPHRINE | A | 2HKK | 0.7 | |
CZM | 'N,N'-BIS-(2-HYDROXY-3-METHYL-BENZYLIDENE)- BENZENE-1,2-DIAMINE' | A | 1J3F | 0.72 | |
CZM | 'N,N'-BIS-(2-HYDROXY-3-METHYL-BENZYLIDENE)- BENZENE-1,2-DIAMINE' | A | 1UFJ | 0.72 | |
CZM | 'N,N'-BIS-(2-HYDROXY-3-METHYL-BENZYLIDENE)- BENZENE-1,2-DIAMINE' | A | 1V9Q | 0.72 | |
TY3 | 3-HYDROXY-L-TYROSINE | A,B | 2VH3 | 0.72 | |
TYL | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | B,C,D | 1TYM | 0.7 | |
TYL | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | B,C,D | 1TYL | 0.7 | |
TYL | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | A | 2OCU | 0.7 | |
TYL | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | A,B,C,D,F | 3DJI | 0.7 | |
TYL | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | A | 2DPZ | 0.7 | |
SOA | ISATOIC ANHYDRIDE | A | 1BIO | 0.74 | |
LNR | L-NOREPINEPHRINE | A,B | 2QEO | 0.74 | |
LNR | L-NOREPINEPHRINE | A | 3DYE | 0.74 | |
LNR | L-NOREPINEPHRINE | A | 4PAH | 0.74 | |
D1N | NAPHTHALENE-1,2-DIOL | A | 2EI1 | 0.74 | |
BP6 | 2',6'-DICHLORO-BIPHENYL-2,6-DIOL | A | 1LKD | 0.71 | |
AA6 | 3-[4,5-DIHYDROXY-2-2-(2-HYDROXYETHYLAMINO)- PHENYL]-2-METHYLAMINO-PROPIONIC ACID | E,I | 1QR3 | 0.7 | |
FEN | N-(4-HYDROXYPHENYL)ALL-TRANS RETINAMIDE | A | 1FEL | 0.73 | |
NCR | 2-NITRO-P-CRESOL | A,B | 1AHV | 0.7 | |
Y13 | (2E)-3-(3,4-DIHYDROXYPHENYL)-N- [2-(4-HYDROXYPHENYL)ETHYL]ACRYLAMIDE | A | 2EW6 | 0.71 | |
NAB | A,B | 1SRJ | 0.71 | ||
LDP | L-DOPAMINE | A,B | 2A3R | 0.79 | |
LDP | L-DOPAMINE | A | 5PAH | 0.79 | |
LDP | L-DOPAMINE | A,B | 2QMZ | 0.79 | |
LDP | L-DOPAMINE | A,B | 2VQ5 | 0.79 | |
MHB | A,B | 1SRG | 0.72 | ||
CSN | N,4-DIHYDROXY-N-OXO-3-(SULFOOXY)BENZENAMINIUM | P | 1E2S | 0.71 | |
CSN | N,4-DIHYDROXY-N-OXO-3-(SULFOOXY)BENZENAMINIUM | A | 1PA9 | 0.71 | |
2AC | 2-AMINO-P-CRESOL | H,I | 1A2C | 0.78 | |
2AC | 2-AMINO-P-CRESOL | A | 1L4M | 0.78 | |
AED | 4-(2-aminoethyl)-2-cyclohexylphenol | A | 3BUH | 0.74 | |
BIE | (3,4-DIHYDROXY-2-NITROPHENYL)(PHENYL)METHANONE | A,B | 2CL5 | 0.71 | |
SAF | 3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL | A | 1GQR | 0.72 | |
SAF | 3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL | A | 1GQS | 0.72 | |
4NL | 4-AMINOPHENOL | A | 2ORL | 0.76 | |
MNY | 5,8-DI-AMINO-1,4-DIHYDROXY-ANTHRAQUINONE | A | 1M2R | 0.74 | |
2AF | 2-AMINOPHENOL | A | 1L4N | 0.73 |