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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03245726

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PQ95-[(2E,6E,10E,14E,18E,22E)-3,7,11,15,19,23,27-
HEPTAMETHYLOCTACOSA-2,6,10,14,18,22,26-
HEPTAENYL]-2,3-DIMETHYLBENZO-1,4-
QUINONE
A,B,C,D,E,H,
J,K,L,T,V,Z
3A0B0.76
PQ95-[(2E,6E,10E,14E,18E,22E)-3,7,11,15,19,23,27-
HEPTAMETHYLOCTACOSA-2,6,10,14,18,22,26-
HEPTAENYL]-2,3-DIMETHYLBENZO-1,4-
QUINONE
A,B,C,D,F,H,
K,L,T,V,Z
3A0H0.76
PQ95-[(2E,6E,10E,14E,18E,22E)-3,7,11,15,19,23,27-
HEPTAMETHYLOCTACOSA-2,6,10,14,18,22,26-
HEPTAENYL]-2,3-DIMETHYLBENZO-1,4-
QUINONE
A,B,C,D,F,H,
I,K,L,M,T,V,X
2AXT0.76
AZEALL-TRANS AXEROPHTHENEA2G7B0.71
AZEALL-TRANS AXEROPHTHENEA1FEN0.71
OXR4-OXORETINOLA,B1X8L0.73
RETRETINALA1H2S0.76
RETRETINALA,B3COD0.76
RETRETINALA1JGJ0.76
RETRETINALA1AP90.76
RETRETINALA1BRX0.76
RETRETINALA2ZFE0.76
RETRETINALA,B1Q5I0.76
RETRETINALA1O0A0.76
RETRETINALA2AT90.76
RETRETINALA,B1PY60.76
RETRETINALA1QM80.76
RETRETINALA2I1X0.76
RETRETINALA,B2HPY0.76
RETRETINALA1P8U0.76
RETRETINALA1GUE0.76
RETRETINALA,B,C1BRR0.76
RETRETINALA,B1KME0.76
RETRETINALA1MGY0.76
RETRETINALA,B1E120.76
RETRETINALA1FBB0.76
RETRETINAL11X0I0.76
RETRETINALA1P8H0.76
RETRETINAL11X0K0.76
RETRETINALA,B1PXR0.76
RETRETINALA2G790.76
RETRETINALA3C9M0.76
RETRETINALA,B3COC0.76
RETRETINALA1XJI0.76
RETRETINALA,B1GZM0.76
RETRETINALA2JAF0.76
RETRETINALA1F4Z0.76
RETRETINALA1R2N0.76
RETRETINALA1UCQ0.76
RETRETINALA,B1S530.76
RETRETINALA2I210.76
RETRETINALA,B1PXS0.76
RETRETINALA,B1E0P0.76
RETRETINALA1M0L0.76
RETRETINALA3C9L0.76
RETRETINALA1JV70.76
RETRETINALA1KG90.76
RETRETINALA1S8J0.76
RETRETINALA,B2Z730.76
RETRETINALA,B1S540.76
RETRETINALA1AT90.76
RETRETINALA1C8R0.76
RETRETINALA,B1CWQ0.76
RETRETINALA1QHJ0.76
RETRETINALA,B,C,D1OPB0.76
RETRETINALA1DZE0.76
RETRETINALA1IXF0.76
RETRETINALA,B1S520.76
RETRETINALA,B,D,E2Z550.76
RETRETINALA1X0S0.76
RETRETINALA,B1S510.76
RETRETINALA1C8S0.76
RETRETINALA2NTU0.76
RETRETINALA1C3W0.76
RETRETINALA,B1TN00.76
RETRETINALA,B1TN50.76
RETRETINALA,B1U190.76
RETRETINALA2F950.76
RETRETINALA,B1F880.76
RETRETINALA1GU80.76
RETRETINALA1QKO0.76
RETRETINALA,B3DDL0.76
RETRETINALA,B1HZX0.76
RETRETINALA,B2PED0.76
RETRETINALA1P8I0.76
RETRETINALA1LN60.76
RETRETINALA2I200.76
RETRETINALA1H680.76
RETRETINALA2I350.76
RETRETINALA1R840.76
RETRETINALA1BRD0.76
RETRETINALA2F930.76
RETRETINALA2ZIY0.76
RETRETINALA1KG80.76
RETRETINALA1QKP0.76
RETRETINALA2BRD0.76
RETRETINALA1JV60.76
RETRETINALA,B1L9H0.76
RETRETINALA1FBK0.76
RETRETINALA1IW60.76
RETRETINALA1M0M0.76
RETRETINALA1VJM0.76
RETRETINALA1BM10.76
RETRETINALA2JAG0.76
RETRETINALA2NTW0.76
RETRETINALA,B1UAZ0.76
RETRETINALA1S8L0.76
RETRETINALA1KGB0.76
RETRETINALA1IW90.76
RETRETINALA,B1VGO0.76
RETRETINALA,B2G870.76
RETRETINALA1XIO0.76
RETRETINALA1JFP0.76
RETRETINALA2EI40.76
RETRETINALA1M0K0.76
RETRETINALA1F500.76
RETRETINALA,B1Q5J0.76
ANRANHYDRORETINOLA,B1X8K0.7
LSR1,3,3-trimethyl-2-[(1E,3E)-3-methylpenta-
1,3-dien-1-yl]cyclohexene
A3CR60.72
PL92,3-DIMETHYL-5-(3,7,11,15,19,23,27,31,35-
NONAMETHYL-2,6,10,14,18,22,26,30,34-
HEXATRIACONTANONAENYL-2,5-CYCLOHEXADIENE-
1,4-DIONE-2,3-DIMETHYL-5-SOLANESYL-
1,4-BENZOQUINONE
A,B,C,D,F,G,
H,I,J,K,L,M,
O,P,Q,R
1ILX0.76
PL92,3-DIMETHYL-5-(3,7,11,15,19,23,27,31,35-
NONAMETHYL-2,6,10,14,18,22,26,30,34-
HEXATRIACONTANONAENYL-2,5-CYCLOHEXADIENE-
1,4-DIONE-2,3-DIMETHYL-5-SOLANESYL-
1,4-BENZOQUINONE
A,B,C,D,E,F,
J,K,V
1S5L0.76
PL92,3-DIMETHYL-5-(3,7,11,15,19,23,27,31,35-
NONAMETHYL-2,6,10,14,18,22,26,30,34-
HEXATRIACONTANONAENYL-2,5-CYCLOHEXADIENE-
1,4-DIONE-2,3-DIMETHYL-5-SOLANESYL-
1,4-BENZOQUINONE
A,B,C,D,E,N,
O,P,Q,R
1VF50.76
PL92,3-DIMETHYL-5-(3,7,11,15,19,23,27,31,35-
NONAMETHYL-2,6,10,14,18,22,26,30,34-
HEXATRIACONTANONAENYL-2,5-CYCLOHEXADIENE-
1,4-DIONE-2,3-DIMETHYL-5-SOLANESYL-
1,4-BENZOQUINONE
A,B,C,D,E,F,
H,I,J,K,M,O,
T,V,Z
3BZ10.76
PL92,3-DIMETHYL-5-(3,7,11,15,19,23,27,31,35-
NONAMETHYL-2,6,10,14,18,22,26,30,34-
HEXATRIACONTANONAENYL-2,5-CYCLOHEXADIENE-
1,4-DIONE-2,3-DIMETHYL-5-SOLANESYL-
1,4-BENZOQUINONE
Z1W5C0.76
PL92,3-DIMETHYL-5-(3,7,11,15,19,23,27,31,35-
NONAMETHYL-2,6,10,14,18,22,26,30,34-
HEXATRIACONTANONAENYL-2,5-CYCLOHEXADIENE-
1,4-DIONE-2,3-DIMETHYL-5-SOLANESYL-
1,4-BENZOQUINONE
A,B,C,D,E,F,
H,I,J,K,L,M,
O,T,V,X,Z
3BZ20.76