On Target ESR1_HUMAN 0.3465909/CHEMBL153115
For the given ligand Sitagliptin, we have found in our database that, being scored 0.3465909, the most similar ligand is CHEMBL153115. Check out the elaboration below.
| Sitagliptin (Given Ligand) | CHEMBL153115 (Similar Ligand) |
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| N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc3cc(F)c(F)cc3F | CN(CCCc1ccc(F)c(F)c1)c2nc(NCCc3ccc(O)cc3)nc(n2)N4CCNCC4 |
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| 00010040 01002408 40102102 02010e00 01100600 00100016 08800800 28002401 00100900 001929e0 08310120 d4019800 0c009006 04201000 00020800 0008200c 0100d200 020000a2 00400000 00b61a01 00000103 38232600 21000001 83500418 00010010 c0000400 c0400000 90021001 0c344004 00068013 84200080 00400e00 | 00010000 00000209 20100100 06010600 02000000 00000010 02000000 00100880 00000900 000828c0 08300000 50009000 04000002 00003000 00000000 101c000c 00001000 02004080 00000000 00320001 00000100 3a200000 60004020 83400014 00000000 80000000 80120000 10000041 0c100018 0046800a 80001000 00000600 |