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Histidine

Histidine

SCHEMBL5578065

CSCC[C@H](N)C(=O)OC(=O)[C@@H](N)CC(C)C.C[C@@H](O)[C@H](N)C(=O)O.C[C@H](N)C(=O)O.NCC(=O)O.NCCCC[C@H](N)C(=O)O.N[C@@H](Cc1c[nH]cn1)C(=O)O.O=C(O)[C@@H]1CCCN1

nearest known ligand 0.00

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Known targets — ChEMBL curated mechanism

PPARDPTGS1PTGS2dacAdacBdacCftsImrcAmrcBmrdA

The experimentally established mechanism targets of Histidine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Lysine SCHEMBL5577931 0.85 — —
Histidine SCHEMBL7758642 0.85 CALCR (0.34) —
Histidine SCHEMBL285813 0.83 GSR (0.33) —
Cystine SCHEMBL27454820 0.83 CRHR1 (0.32) —
Histidine SCHEMBL17685559 0.82 GSR (0.33) —
Histidine SCHEMBL7758637 0.82 CALCR (0.32) —
Histidine SCHEMBL5578200 0.81 — —
Histidine SCHEMBL7757149 0.81 — —
Histidine SCHEMBL6554652 0.81 — —
Histidine SCHEMBL19809592 0.81 — —

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070166699-A1 Combination of anti-hpv-16 and 18 antibodies and uses thereof AMYNON BIOTECH GMBH 2007-07-19 — — US disclosed
EP-1664785-A1 COMBINATION OF ANTI-HPV-16 AND 18 ANTIBODIES AND USES THEREOF Amynon BioTech GmbH (AT) 2006-06-07 — — EP disclosed
WO-2005026731-A1 COMBINATION OF ANTI-HPV-16 AND 18 ANTIBODIES AND USES THEREOF AMYNON BIOTECH GMBH (AT) 2005-03-24 — — WO disclosed