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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03039024

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DAH3,4-DIHYDROXYPHENYLALANINEA,B1RNR0.73
DAH3,4-DIHYDROXYPHENYLALANINEA6PAH0.73
DAH3,4-DIHYDROXYPHENYLALANINEA,B1IVV0.73
296(3R)-3-amino-2,2-difluoro-3-(4-
methoxyphenyl)propanoic acid
A,B2RJS0.83
34C(3-CHLORO-4-PROPOXY-PHENYL)-ACETIC ACIDA,B1HT80.76
DRS(9S,12S)-9-(1-methylethyl)-7,10-
dioxo-2-oxa-8,11-diazabicyclo[12.2.2]octadeca-
1(16),14,17-triene-12-carboxylic acid
A,B3BXS0.72
CNTN-METHYL-META-CHLORO-TYROSINEC,D1OKX0.77
CHP3-CHLORO-4-HYDROXYPHENYLGLYCINEA1DSR0.85
D4P(2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA1DSR0.8
D4P(2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D,E,F,
G,H
1W7R0.8
D4P(2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1W7Q0.8
C187-[(3-CHLOROBENZYL)OXY]-4-[(METHYLAMINO)METHYL]-
2H-CHROMEN-2-ONE
A,B2V610.71
B3Y(3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACIDA3HF00.72
B3Y(3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACIDA2OXK0.72
B3Y(3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACIDA,B,C2OXJ0.72
1771-[2-AMINO-2-CYCLOHEXYL-ACETYL]-
PYRROLIDINE-3-CARBOXYLIC ACID 5-
CHLORO-2-(2-ETHYLCARBAMOYL-ETHOXY)-
BENZYLAMIDE
A,B1TA60.7
GHP4-HYDROXYPHENYLGLYCINEA1DSR0.8
2TN2-(4-(2-HYDROXY-3-(ISOPROPYLAMINO)PROPOXY)PHENYL)ETHANAMIDEA2OTF0.71
2TN2-(4-(2-HYDROXY-3-(ISOPROPYLAMINO)PROPOXY)PHENYL)ETHANAMIDEA2NUV0.71
2TN2-(4-(2-HYDROXY-3-(ISOPROPYLAMINO)PROPOXY)PHENYL)ETHANAMIDEA2OUB0.71
FCL3-CHLORO-L-PHENYLALANINEE,F1OKW0.71
2004-CHLORO-L-PHENYLALANINEA,B2AKW0.71
247(3R)-3-amino-2,2-difluoro-3-(4-
hydroxyphenyl)propanoic acid
A,B2QVE0.75
FLTFLUOROMALONYL TYROSINEI1BZH0.74
DTYD-TYROSINEA1C4B0.75
DTYD-TYROSINEA,L1ZEA0.75
DTYD-TYROSINEA,B,C,D,E,F,
G,H
1OF60.75
DTYD-TYROSINEA,B1UNO0.75
DTYD-TYROSINEA2IGZ0.75
DTYD-TYROSINEA,B,C,H,K,L2R5D0.75
DTYD-TYROSINEA,B2Q330.75
DTYD-TYROSINEH,S2H9E0.75
DTYD-TYROSINEA,B,C,H,K,L2R5B0.75
DTYD-TYROSINEA2IH00.75
DTYD-TYROSINEA1D7T0.75
DTYD-TYROSINEA,B1XA00.75
DGH(2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1W7Q0.8
DGH(2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D,E,F,
G,H
1W7R0.8
3MB3-METHOXYBENZAMIDEA3PAX0.73
D3P(2R)-AMINO(3,5-DIHYDROXYPHENYL)ACETIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1W7Q0.71
D3P(2R)-AMINO(3,5-DIHYDROXYPHENYL)ACETIC ACIDA,B,C,D,E,F,
G,H
1W7R0.71