On Target HYES_HUMAN 0.30769232/CHEMBL589133
For the given ligand DS-245, we have found in our database that, being scored 0.30769232, the most similar ligand is CHEMBL589133. Check out the elaboration below.
| DS-245 (Given Ligand) | CHEMBL589133 (Similar Ligand) |
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| CCCC(NC(=O)C(CCSC)NC(=O)c1cc(Cl)cc(Cl)c1)c3nc2CCCCc2s3 | Clc1ccc(CNC(=O)N2CCC(Cc3ccccn3)CC2)c(Cl)c1 |
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| 0002800a 09003900 02100902 15910e54 18000100 02120022 074030a0 2a01f00f 84400800 004948d8 00218a00 d004b820 060188d6 08243c21 84422400 00040304 04009200 060000a6 00202018 80004a41 44101800 f88f8780 20004309 52c1001c 02143000 cc010401 00200a00 90003184 080a0304 04861825 a8044080 21032210 | 0000800a 01801000 00104102 10010e00 00040020 00000020 01000004 22003000 00100800 000808c0 09308004 50818800 02009846 00200400 00020000 02040004 00004000 06000000 00200048 00000201 c0200900 18058500 20800000 00500018 00412000 80000200 00040040 90000280 00000104 00860003 080c0000 a0020600 |