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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02327648

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
BFC(R)-3-HYDROXYTETRADECANALA2NPV0.78
DHT5-ALPHA-DIHYDROTESTOSTERONEL2PIP0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T7M0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1I380.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T740.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T7R0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PKL0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T630.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1KDK0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1DHT0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIR0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T760.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA2Z4J0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T790.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIO0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIV0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA2QPY0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA2AMA0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T650.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIX0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1KDM0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T7T0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T5Z0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIQ0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIT0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIU0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA2PIW0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1I370.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1XJ70.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1D2S0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1F5F0.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T730.73
DHT5-ALPHA-DIHYDROTESTOSTERONEA1T7F0.73
3OC(1R)-3-oxocyclohexanecarboxylic acidA,B3DZL0.7
CAX(2S,4S)-4-(2,2-DIHYDROXYETHYL)-
2,3,3-TRIMETHYLCYCLOPENTANONE
A,B,C,D,E,F,
G,H,I,J,K,L
1SZO0.73
YML[(3R,4S,5S,7R)-4,8-DIHYDROXY-3,5,7-
TRIMETHYL-2-OXOOCTYL]PHOSPHONIC ACID
A,B2HFJ0.8
FTT3-HYDROXY-TETRADECANOIC ACIDA1QFF0.75
FTT3-HYDROXY-TETRADECANOIC ACIDA1QJQ0.75
FTT3-HYDROXY-TETRADECANOIC ACIDA,B2GRX0.75
FTT3-HYDROXY-TETRADECANOIC ACIDA1QFG0.75
FTT3-HYDROXY-TETRADECANOIC ACIDA1QKC0.75
FTT3-HYDROXY-TETRADECANOIC ACIDA1FI10.75
FTT3-HYDROXY-TETRADECANOIC ACIDA,B,C,D3FXI0.75
CXPCYCLOHEXANE PROPIONIC ACIDA,B2AY20.75
HXD(3R)-3-HYDROXYDODECANOIC ACIDA2DDH0.75
LNG12-METHYLTRIDECANOIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1W3M0.73
F24(3R,5S,7R,12S,13R)-13-FORMYL-12,14-
DIHYDROXY-3,5,7-TRIMETHYLTETRADECANOIC ACID
A2F9A0.78
CAH5-EXO-HYDROXYCAMPHORA1NOO0.78
DEB6-DEOXYERYTHRONOLIDE BA1Z8P0.75
DEB6-DEOXYERYTHRONOLIDE BA1JIO0.75
DEB6-DEOXYERYTHRONOLIDE BA1Z8Q0.75
DEB6-DEOXYERYTHRONOLIDE BA1OXA0.75
DEB6-DEOXYERYTHRONOLIDE BA1Z8O0.75
AE2AETIOCHOLANOLONEA2QP40.73
AE2AETIOCHOLANOLONEA,B1YB10.73
AE2AETIOCHOLANOLONEA2QP30.73
AE2AETIOCHOLANOLONEA,B1X8J0.73
AE2AETIOCHOLANOLONEA,B,C,D1NFQ0.73
AE2AETIOCHOLANOLONEH1DBJ0.73
AE2AETIOCHOLANOLONEA1OV40.73
KTA(S)-CYCLOHEXANONE-2-ACETATEA,B2J5S0.73
BDT5-beta-DIHYDROTESTOSTERONEA,B3DOP0.73