On Target TF65_HUMAN 0.35744682/CHEMBL5434230
For the given ligand Methotrexate, we have found in our database that, being scored 0.35744682, the most similar ligand is CHEMBL5434230. Check out the elaboration below.
| Methotrexate (Given Ligand) | CHEMBL5434230 (Similar Ligand) |
|---|---|
| CN(Cc2cnc1nc(N)nc(N)c1n2)c3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3 | CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O |
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| 1003c00a 01a05800 00180902 98090e30 0a1a10c8 0010c000 0000e000 22001801 10400100 000208c0 41210004 4000b000 06008822 02108000 008e0440 100c010c 18040000 02000000 08400000 40200201 40100000 1c068e40 23810840 0040001c 00140000 c0000001 08008000 9000008c 0000810c 00461801 e0044000 80800ac0 | 04070002 01007a08 20100100 45810610 041c12c0 00000000 02002020 2000000c 00600980 000b0ac0 28308004 5003b800 1e008832 01502801 811a0040 000c000c 10000000 0e000000 00e00418 40020201 60000d00 38248e28 238000c3 93500018 00043801 80000200 08120000 10000100 0c000006 0046000b 60044200 20802e20 |