Substructure Enrichment Report

Mapping Details for your submission help

# Active Inactive
Your Submission 4039 1323

Table 1. Substructure Enrichment help

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# Substructure Odds Ratio p-value kA Active kB InActive
1 C(C(CC)CC)(N(C)C)C 5.46 2.22e-05 117 4044 7 1323
2 C(OCCCC)CN(S)C 4.71 6.56e-19 360 4044 25 1323
3 c1cc(ccc1C#C)F 4.12 0.37 63 4044 5 1323
4 N(CCC(CO)N)[S](=O)=O 4.01 0.0306 86 4044 7 1323
5 C1(=CC(C=CC1)F)C#C 3.86 0.93 59 4044 5 1323

Table 2. Substructure Enrichment help

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# Substructure Odds Ratio p-value kA Active kB InActive
1 C(N(C)C)C(C)C AND C(#CC)CC(C)C 17.01 0.99 52 4044 1 1323
2 c1c(ccc(c1)C)SN AND C(CNS)(OCC)CC 16.68 0.00028 102 4044 2 1323
3 c1c(ccc(c1)C)SN AND C(OCCCC)CN(S)C 15.86 0.0011 97 4044 2 1323
4 C(C(CC)C)N(C)C AND C(#CC)CC(C)C 15.04 0.99 46 4044 1 1323
5 C(CNC)OC AND c1(c(cccc1)F)SN 15.04 0.99 46 4044 1 1323

Table 3. Substructure Enrichment help

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# Substructure Odds Ratio p-value kA Active kB InActive
1 c1cc(ccc1N)C AND C(CNCN)(OCC)CC AND C1(=CC(C=CC1)C)NC 26.17 0.99 80 4044 1 1323
2 c1c(ccc(c1)C)SN AND C(C(CN(C)C)C)CNS AND c1(ccccc1)NS 21.59 0.99 66 4044 1 1323
3 c1c(ccc(c1)C)SN AND C(CNS)(OCC)CC AND c1(ccccc1)NS 21.26 0.99 65 4044 1 1323
4 c1c(ccc(c1)C)SN AND C(N([S]=O)C)COCC AND C(C)(C)C 16.68 0.99 102 4044 2 1323
5 c1(ccccc1)C#C AND N(CC(CC)C)CC(O)C AND C(CNC)CCC 16.68 0.99 51 4044 1 1323