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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02391758

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
BCRBETA-CAROTENEA,B,C,D,E,F,
H,I,J,K,L,M,
O,T,V,X,Z
3BZ20.7
BCRBETA-CAROTENEA,B,C,D,G,H2ZT90.7
BCRBETA-CAROTENEA,B,C,D,G2E750.7
BCRBETA-CAROTENEA,B,C,D,L,R1Q900.7
BCRBETA-CAROTENEA,B,C,D,G,H2E740.7
BCRBETA-CAROTENEA,B,C,F,I,J,
K,L,M,X
1JB00.7
BCRBETA-CAROTENE1,2,3,4,A,B,
C,F,G,H,I,J,
K,L
2O010.7
BCRBETA-CAROTENEA,B,C,D,F,H,
K,L,T,V,Z
3A0H0.7
BCRBETA-CAROTENEZ1W5C0.7
BCRBETA-CAROTENEA,B,C,D,F,H,
I,K,L,M,T,V,X
2AXT0.7
BCRBETA-CAROTENEA,B,C,D,E,H,
J,K,L,T,V,Z
3A0B0.7
BCRBETA-CAROTENE0,A,B,C,D,E,
G,J,K,L,M,N,
P,R,V,W
1IZL0.7
BCRBETA-CAROTENEA,B,C,D,G2E760.7
BCRBETA-CAROTENEA,B,C,D,E,F,
J,K,V
1S5L0.7
BCRBETA-CAROTENEA,B,C,D,E,N,
O,P,Q,R
1VF50.7
BCRBETA-CAROTENEA,B,C,D,E,N,
O,P,Q,R
2D2C0.7
BCRBETA-CAROTENEA,B,C,D,E,F,
H,I,J,K,M,O,
T,V,Z
3BZ10.7
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
1ILX0.72
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,E,F,
J,K,V
1S5L0.72
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,E,N,
O,P,Q,R
1VF50.72
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,E,F,
H,I,J,K,M,O,
T,V,Z
3BZ10.72
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
Z1W5C0.72
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,E,F,
H,I,J,K,L,M,
O,T,V,X,Z
3BZ20.72
AZEALL-TRANS AXEROPHTHENEA2G7B0.76
AZEALL-TRANS AXEROPHTHENEA1FEN0.76
OXR4-OXORETINOLA,B1X8L0.75
RETRETINALA1H2S0.81
RETRETINALA,B3COD0.81
RETRETINALA1JGJ0.81
RETRETINALA1AP90.81
RETRETINALA1BRX0.81
RETRETINALA2ZFE0.81
RETRETINALA,B1Q5I0.81
RETRETINALA1O0A0.81
RETRETINALA2AT90.81
RETRETINALA,B1PY60.81
RETRETINALA1QM80.81
RETRETINALA2I1X0.81
RETRETINALA,B2HPY0.81
RETRETINALA1P8U0.81
RETRETINALA1GUE0.81
RETRETINALA,B,C1BRR0.81
RETRETINALA,B1KME0.81
RETRETINALA1MGY0.81
RETRETINALA,B1E120.81
RETRETINALA1FBB0.81
RETRETINAL11X0I0.81
RETRETINALA1P8H0.81
RETRETINAL11X0K0.81
RETRETINALA,B1PXR0.81
RETRETINALA2G790.81
RETRETINALA3C9M0.81
RETRETINALA,B3COC0.81
RETRETINALA1XJI0.81
RETRETINALA,B1GZM0.81
RETRETINALA2JAF0.81
RETRETINALA1F4Z0.81
RETRETINALA1R2N0.81
RETRETINALA1UCQ0.81
RETRETINALA,B1S530.81
RETRETINALA2I210.81
RETRETINALA,B1PXS0.81
RETRETINALA,B1E0P0.81
RETRETINALA1M0L0.81
RETRETINALA3C9L0.81
RETRETINALA1JV70.81
RETRETINALA1KG90.81
RETRETINALA1S8J0.81
RETRETINALA,B2Z730.81
RETRETINALA,B1S540.81
RETRETINALA1AT90.81
RETRETINALA1C8R0.81
RETRETINALA,B1CWQ0.81
RETRETINALA1QHJ0.81
RETRETINALA,B,C,D1OPB0.81
RETRETINALA1DZE0.81
RETRETINALA1IXF0.81
RETRETINALA,B1S520.81
RETRETINALA,B,D,E2Z550.81
RETRETINALA1X0S0.81
RETRETINALA,B1S510.81
RETRETINALA1C8S0.81
RETRETINALA2NTU0.81
RETRETINALA1C3W0.81
RETRETINALA,B1TN00.81
RETRETINALA,B1TN50.81
RETRETINALA,B1U190.81
RETRETINALA2F950.81
RETRETINALA,B1F880.81
RETRETINALA1GU80.81
RETRETINALA1QKO0.81
RETRETINALA,B3DDL0.81
RETRETINALA,B1HZX0.81
RETRETINALA,B2PED0.81
RETRETINALA1P8I0.81
RETRETINALA1LN60.81
RETRETINALA2I200.81
RETRETINALA1H680.81
RETRETINALA2I350.81
RETRETINALA1R840.81
RETRETINALA1BRD0.81
RETRETINALA2F930.81
RETRETINALA2ZIY0.81
RETRETINALA1KG80.81
RETRETINALA1QKP0.81
RETRETINALA2BRD0.81
RETRETINALA1JV60.81
RETRETINALA,B1L9H0.81
RETRETINALA1FBK0.81
RETRETINALA1IW60.81
RETRETINALA1M0M0.81
RETRETINALA1VJM0.81
RETRETINALA1BM10.81
RETRETINALA2JAG0.81
RETRETINALA2NTW0.81
RETRETINALA,B1UAZ0.81
RETRETINALA1S8L0.81
RETRETINALA1KGB0.81
RETRETINALA1IW90.81
RETRETINALA,B1VGO0.81
RETRETINALA,B2G870.81
RETRETINALA1XIO0.81
RETRETINALA1JFP0.81
RETRETINALA2EI40.81
RETRETINALA1M0K0.81
RETRETINALA1F500.81
RETRETINALA,B1Q5J0.81
LSR1,3,3-trimethyl-2-[(1E,3E)-3-methylpenta-
1,3-dien-1-yl]cyclohexene
A3CR60.78
ANRANHYDRORETINOLA,B1X8K0.72
REARETINOIC ACIDA1CBS0.73
REARETINOIC ACIDA,B1EPB0.73
REARETINOIC ACIDA,D1K740.73
REARETINOIC ACIDA,D3E000.73
REARETINOIC ACIDA3LBD0.73
REARETINOIC ACIDA,B,C,D,E,F,
G,H
1XLS0.73
REARETINOIC ACIDA,B,C,D,E,F,
G,H
2ACL0.73
REARETINOIC ACIDA,B,C,D3FAL0.73
REARETINOIC ACIDA,D,U,X1FM60.73
REARETINOIC ACIDE,F1RLB0.73
REARETINOIC ACIDA,D3DZU0.73
REARETINOIC ACIDA3CWK0.73
REARETINOIC ACIDA,B2NNH0.73
REARETINOIC ACIDA,B2VE30.73
REARETINOIC ACIDA1N4H0.73
REARETINOIC ACIDA2FR30.73
REARETINOIC ACIDB,C1G5Y0.73
REARETINOIC ACIDA2LBD0.73
REARETINOIC ACIDA,B,E,F1XDK0.73
REARETINOIC ACIDA,D1FM90.73
REARETINOIC ACIDA1FEM0.73
REARETINOIC ACIDA,D3DZY0.73
REARETINOIC ACIDA,B1TYR0.73
REARETINOIC ACIDA2G780.73
REARETINOIC ACIDA1GX90.73
REARETINOIC ACIDA,B,C,D3FC60.73
REARETINOIC ACIDA,B1CBR0.73
REARETINOIC ACIDA,B1FBY0.73
REARETINOIC ACIDA,B1XIU0.73
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
3A0B0.72
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
3A0H0.72
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
2AXT0.72