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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00239052

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DSI4-HYDROXY-6-(1H-INDOLE-2-CARBONYL)-
8-METHYL-3,6,7,8-TETRAHYDRO-3,6-
DIAZA-AS-INDACENE-2-CARBOXYLIC ACID METHYL ESTER
B1DSI0.71
CRR3,4-DI-1H-INDOL-3-YL-1H-PYRROLE-
2,5-DICARBOXYLIC ACID
A2Z3U0.76
SU13-[(3-(2-CARBOXYETHYL)-4-METHYLPYRROL-
2-YL)METHYLENE]-2-INDOLINONE
A,B1FGI0.7
OAI6-(OXALYL-AMINO)-1H-INDOLE-5-CARBOXYLIC ACIDA1C830.72
208(2S)-3-(1-{[2-(2-CHLOROPHENYL)-
5-METHYL-1,3-OXAZOL-4-YL]METHYL}-
1H-INDOL-5-YL)-2-ETHOXYPROPANOIC ACID
A2GTK0.71
PHOPHEOPHYTIN AA,B,C,D,F,H,
K,L,T,V,Z
3A0H0.71
PHOPHEOPHYTIN AZ1W5C0.71
PHOPHEOPHYTIN AA,B,C,D,F,H,
I,K,L,M,T,V,X
2AXT0.71
PHOPHEOPHYTIN AA,B,C,D,E,H,
J,K,L,T,V,Z
3A0B0.71
PHOPHEOPHYTIN AA,B,C,D,E,F,
H,I,J,K,M,O,
T,V,Z
3BZ10.71
PHOPHEOPHYTIN A0,A,B,C,D,E,
G,J,K,L,M,N,
P,R,V,W
1IZL0.71
PHOPHEOPHYTIN AA,B,C,D,E,F,
J,K,V
1S5L0.71
PHOPHEOPHYTIN AA,B,C,D,F,G,
H,I,J,K,L,M,
O,P,Q,R
1ILX0.71
PHOPHEOPHYTIN AA,B,C,D,F,G,
H,I,J,K,L,M,
O,P,Q,R
1FE10.71
PHOPHEOPHYTIN AA,B,C,D,E,F,
H,I,J,K,L,M,
O,T,V,X,Z
3BZ20.71
EHA(5-{3-[(6-BENZOYL-1-PROPYL-2-NAPHTHYL)OXY]PROPOXY}-
1H-INDOL-1-YL)ACETIC ACID
A2F4B0.72
BPBBACTERIOPHEOPHYTIN BC,H,L,M3PRC0.7
BPBBACTERIOPHEOPHYTIN BC,H,L,M6PRC0.7
BPBBACTERIOPHEOPHYTIN BH,L,M1RY50.7
BPBBACTERIOPHEOPHYTIN BH,L,M1RZH0.7
BPBBACTERIOPHEOPHYTIN BL,M,R,S1RZZ0.7
BPBBACTERIOPHEOPHYTIN BL,M,R,S1S000.7
BPBBACTERIOPHEOPHYTIN BC,H,L,M2JBL0.7
BPBBACTERIOPHEOPHYTIN BC,H,L,M1VRN0.7
BPBBACTERIOPHEOPHYTIN BC,H,L,M7PRC0.7
BPBBACTERIOPHEOPHYTIN BC,H,L,M2PRC0.7
BPBBACTERIOPHEOPHYTIN BH,L,M1UMX0.7
BPBBACTERIOPHEOPHYTIN BC,H,L,M1R2C0.7
BPBBACTERIOPHEOPHYTIN BC,H,L,M3D380.7
BPBBACTERIOPHEOPHYTIN BC,H,L,M2I5N0.7
BPBBACTERIOPHEOPHYTIN BC,H,L,M5PRC0.7
BPBBACTERIOPHEOPHYTIN BC,H,L,M1PRC0.7
BPBBACTERIOPHEOPHYTIN BH,L,M1RVJ0.7
BPBBACTERIOPHEOPHYTIN BC,H,L,M,U1DXR0.7
LY4(9R)-9-[(DIMETHYLAMINO)METHYL]-
6,7,10,11-TETRAHYDRO-9H,18H-5,21:12,17-
DIMETHENODIBENZO[E,K]PYRROLO[3,4-
H][1,4,13]OXADIAZACYCLOHEXADECINE-
18,20-DIONE
B2J2I0.71
LY4(9R)-9-[(DIMETHYLAMINO)METHYL]-
6,7,10,11-TETRAHYDRO-9H,18H-5,21:12,17-
DIMETHENODIBENZO[E,K]PYRROLO[3,4-
H][1,4,13]OXADIAZACYCLOHEXADECINE-
18,20-DIONE
A1UU30.71
T19PHENYLMETHYLENECARBOXY-(METHYLENEAMINO-
FORMYL-DIPHENYLMETHYL)METHY-PRO-
BOROVAL
H,I1AIX0.76
MOCCARBAMIC ACID 2,6-DIAMINO-5-METHYL-
4,7-DIOXO-2,3,4,7-TETRAHYDRO-1H-
3A-AZA-CYCLOPENTA[A]INDEN-8-YLMETHYL ESTER
A199D0.71
BPHBACTERIOPHEOPHYTIN AH,L,M1RG50.7
BPHBACTERIOPHEOPHYTIN AH,L,M2UWT0.7
BPHBACTERIOPHEOPHYTIN A1,2,3,5,6,7,
8,A,B,D,E,F,
G,H,I,J,K,L,
M,N,P,R,S,T,
U,V,W,Y
1PYH0.7
BPHBACTERIOPHEOPHYTIN AA,B,C1Z9K0.7
BPHBACTERIOPHEOPHYTIN AH,L,M2UXK0.7
BPHBACTERIOPHEOPHYTIN AH,L,M1RY50.7
BPHBACTERIOPHEOPHYTIN AH,L,M1RZH0.7
BPHBACTERIOPHEOPHYTIN AC,H,L,M1EYS0.7
BPHBACTERIOPHEOPHYTIN AH,L,M2UWS0.7
BPHBACTERIOPHEOPHYTIN AL,M4RCR0.7
BPHBACTERIOPHEOPHYTIN AH,L,M1K6N0.7
BPHBACTERIOPHEOPHYTIN AL,M1YF60.7
BPHBACTERIOPHEOPHYTIN AH,L,M2UX50.7
BPHBACTERIOPHEOPHYTIN AH,L,M3DTS0.7
BPHBACTERIOPHEOPHYTIN AC1E140.7
BPHBACTERIOPHEOPHYTIN AH,L,M3DTA0.7
BPHBACTERIOPHEOPHYTIN AL,M1PST0.7
BPHBACTERIOPHEOPHYTIN AL,M1KBY0.7
BPHBACTERIOPHEOPHYTIN AC,H,L,M1L9B0.7
BPHBACTERIOPHEOPHYTIN AL,M2RCR0.7
BPHBACTERIOPHEOPHYTIN AL,M1PCR0.7
BPHBACTERIOPHEOPHYTIN AL,M1M3X0.7
BPHBACTERIOPHEOPHYTIN AH,L,M2HJ60.7
BPHBACTERIOPHEOPHYTIN AH,L,M,R,S,T1DS80.7
BPHBACTERIOPHEOPHYTIN AH,L,M1FNQ0.7
BPHBACTERIOPHEOPHYTIN AH,L,M2UXJ0.7
BPHBACTERIOPHEOPHYTIN AL,M1QOV0.7
BPHBACTERIOPHEOPHYTIN AH,L,M3DU30.7
BPHBACTERIOPHEOPHYTIN AH,L,M2UX40.7
BPHBACTERIOPHEOPHYTIN AL,M,R,S1AIJ0.7
BPHBACTERIOPHEOPHYTIN AL,M,N,O1AIG0.7
BPHBACTERIOPHEOPHYTIN AH,L,M1RGN0.7
BPHBACTERIOPHEOPHYTIN AL,M1JGX0.7
BPHBACTERIOPHEOPHYTIN AH,L,M2UWV0.7
BPHBACTERIOPHEOPHYTIN AH,L,M1RQK0.7
BPHBACTERIOPHEOPHYTIN AH,L,M,R,S,T1DV60.7
BPHBACTERIOPHEOPHYTIN AH,L,M2UWW0.7
BPHBACTERIOPHEOPHYTIN AL,M,R,S1RZZ0.7
BPHBACTERIOPHEOPHYTIN AL,M,R,S1S000.7
BPHBACTERIOPHEOPHYTIN AH,L,M2HG30.7
BPHBACTERIOPHEOPHYTIN AH,L,M2UX30.7
BPHBACTERIOPHEOPHYTIN AL,M1OGV0.7
BPHBACTERIOPHEOPHYTIN AH,L,M3DUQ0.7
BPHBACTERIOPHEOPHYTIN AA,B1Z9J0.7
BPHBACTERIOPHEOPHYTIN AH,L,M2GNU0.7
BPHBACTERIOPHEOPHYTIN AC1E6D0.7
BPHBACTERIOPHEOPHYTIN AL,M1MPS0.7
BPHBACTERIOPHEOPHYTIN AL,M,X2UXM0.7
BPHBACTERIOPHEOPHYTIN AH,L,M1RVJ0.7
BPHBACTERIOPHEOPHYTIN AH,L,M2UXL0.7
BPHBACTERIOPHEOPHYTIN AC,D,L,M,R,S1L9J0.7
BPHBACTERIOPHEOPHYTIN AL,M2JJ00.7
BPHBACTERIOPHEOPHYTIN AL,M1JH00.7
BPHBACTERIOPHEOPHYTIN AH,L,M2GMR0.7
BPHBACTERIOPHEOPHYTIN AH,L,M3DU20.7
BPHBACTERIOPHEOPHYTIN AL,M1PSS0.7
BPHBACTERIOPHEOPHYTIN AH,L,M2HG90.7
BPHBACTERIOPHEOPHYTIN AH,L,M2HIT0.7
BPHBACTERIOPHEOPHYTIN AH,L,M2JIY0.7
BPHBACTERIOPHEOPHYTIN AH,L,M2UWU0.7
BPHBACTERIOPHEOPHYTIN AL,M1JGZ0.7
BPHBACTERIOPHEOPHYTIN AH,L,M2J8C0.7
BPHBACTERIOPHEOPHYTIN AH,L,M,R,S,T1DV30.7
BPHBACTERIOPHEOPHYTIN AH,L,M3DSY0.7
BPHBACTERIOPHEOPHYTIN AH,L,M1F6N0.7
BPHBACTERIOPHEOPHYTIN AH,L,M1FNP0.7
BPHBACTERIOPHEOPHYTIN AH,L,M1K6L0.7
BPHBACTERIOPHEOPHYTIN AH,L,M2HHK0.7
BPHBACTERIOPHEOPHYTIN AL,M1JGW0.7
BPHBACTERIOPHEOPHYTIN AH,L,M2J8D0.7
BPHBACTERIOPHEOPHYTIN AL,M1YST0.7
BPHBACTERIOPHEOPHYTIN AH,L,M3DTR0.7
BPHBACTERIOPHEOPHYTIN AL,M1JGY0.7
BPHBACTERIOPHEOPHYTIN AH,L,M2HH10.7
AG1RUTHENIUM PYRIDOCARBAZOLEA,B2JLD0.7
CBB1-(3-CARBAMIMIDOYL-BENZYL)-1H-INDOLE-
2-CARBOXYLIC ACID 3-CARBAMIMIDOYL-
BENZYLESTER
B1LPK0.78
L92(2S)-3-{4-[3-(5-METHYL-2-PHENYL-
1,3-OXAZOL-4-YL)PROPYL]PHENYL}-
2-(1H-PYRROL-1-YL)PROPANOIC ACID
A2Q8S0.76
CMF3-CYCLOHEXYL-1-(2-MORPHOLIN-4-YL-
2-OXOETHYL)-2-PHENYL-1H-INDOLE-
6-CARBOXYLIC ACID
A2BRK0.74
6691-(5-CARBOXYPENTYL)-5-(2,6-DICHLOROBENZYLOXY)-
1H-INDOLE-2-CARBOXYLIC ACID
A1MZS0.71
POO3-CYCLOHEXYL-1-(2-{METHYL[(1-METHYLPIPERIDIN-
3-YL)METHYL]AMINO}-2-OXOETHYL)-
2-PHENYL-1H-INDOLE-6-CARBOXYLIC ACID
A2BRL0.71
V25ethyl 3-[(E)-2-amino-1-cyanoethenyl]-
6,7-dichloro-1-methyl-1H-indole-
2-carboxylate
A2VAG0.72
2CC3,4-bis(7-chloro-1H-indol-3-yl)-
1H-pyrrole-2,5-dicarboxylic acid
A3A1L0.7
PYB4-AMINO-(1-METHYLPYRROLE)-2-CARBOXYLIC ACIDA,D,E,G,I,J1S320.74
PYB4-AMINO-(1-METHYLPYRROLE)-2-CARBOXYLIC ACIDD,I,J1M180.74
PYB4-AMINO-(1-METHYLPYRROLE)-2-CARBOXYLIC ACIDE,I,J1M1A0.74
PYB4-AMINO-(1-METHYLPYRROLE)-2-CARBOXYLIC ACIDE,I,J1M190.74
627N-[(3E)-5-[(2R)-2-METHOXY-2-PHENYLACETYL]PYRROLO[3,4-
C]PYRAZOL-3(5H)-YLIDENE]-4-(4-METHYLPIPERAZIN-
1-YL)BENZAMIDE
A,B2J500.76
627N-[(3E)-5-[(2R)-2-METHOXY-2-PHENYLACETYL]PYRROLO[3,4-
C]PYRAZOL-3(5H)-YLIDENE]-4-(4-METHYLPIPERAZIN-
1-YL)BENZAMIDE
A,B2V7A0.76
C80(2S,4S,5R,7R)-4-AMINO-8-(BUTYLAMINO)-
5-HYDROXY-2,7-DIMETHYL-8-OXOOCTYL 1-
BENZYL-1H-INDOLE-3-CARBOXYLATE
C,O2V110.73
2S2(2S)-2-(1H-indol-3-yl)hexanoic acidB3C6O0.7
162(2-{2-[(5-CARBAMIMIDOYL-1-METHYL-
1H-PYRROL-3-YLMETHYL)-CARBAMOYL]-
PYRROL-1-YL} -1-CYCLOHEXYLMETHYL-
2-OXO-ETHYLAMINO)-ACETIC ACID
D,H1NZQ0.71
I3N1-BENZYL-5-METHOXY-2-METHYL-1H-
INDOL-3-YL)-ACETIC ACID
A1DCY0.71