Histidine

Histidine

SCHEMBL5580739

NCCCC[C@H](N)C(=O)O.N[C@@H](CS)C(=O)O.N[C@@H](Cc1c[nH]cn1)C(=O)O

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

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.

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGS1 known ✓ P23219 1/20 0.38
GSR P00390 1/20 0.48
CPB2 Q96IY4 6/20 0.39
CPB1 P15086 2/20 0.39
ITGB3 P05106 1/20 0.38
ITGA2B P08514 1/20 0.38
SLC7A11 Q9UPY5 1/20 0.38
ARG1 P05089 1/20 0.36
THRB P10828 1/20 0.35
CYP3A4 P08684 1/20 0.35
SLC7A5 Q01650 1/20 0.35
RNPEP Q9H4A4 1/20 0.34
CYP1A2 P05177 1/20 0.34
MMP2 P08253 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
Histidine SCHEMBL28560079 1.00 GSR (0.48) GSRCPB2CPB1ITGB3ITGA2B
Histidine SCHEMBL4297918 0.94 GSR (0.54) GSRCPB2CPB1ITGB3ITGA2B
Histidine SCHEMBL4294462 0.94 GSR (0.54) GSRCPB2CPB1ITGB3ITGA2B
D-Histidine SCHEMBL902054 0.94 GSR (0.54) GSRCPB2CPB1ITGB3ITGA2B
Histidine SCHEMBL305856 0.94 GSR (0.54) GSRCPB2CPB1ITGB3ITGA2B
Histidine SCHEMBL305855 0.94 GSR (0.54) GSRCPB2CPB1ITGB3ITGA2B
Histidine SCHEMBL18419548 0.94 GSR (0.54) GSRCPB2CPB1ITGB3ITGA2B
Histidine SCHEMBL16714200 0.94 GSR (0.54) GSRCPB2CPB1ITGB3ITGA2B
Histidine SCHEMBL27767215 0.94 GSR (0.54) GSRCPB2CPB1ITGB3ITGA2B
Histidine SCHEMBL27440707 0.94 GSR (0.54) GSRCPB2CPB1ITGB3ITGA2B

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3103446-A2 PHARMACEUTICAL PREPARATION FOR PREVENTING AND TREATING PROGRESSIVE MYOPIA Zakharov, Ivan Dmitrievich (RU) 2016-12-14 EP claimed
EP-3103446-B1 PHARMACEUTICAL PREPARATION FOR PREVENTING AND TREATING PROGRESSIVE MYOPIA ZAKHAROV IVAN DMITRIEVICH (RU) 2024-02-14 EP disclosed
EP-3103446-A2 PHARMACEUTICAL PREPARATION FOR PREVENTING AND TREATING PROGRESSIVE MYOPIA Zakharov, Ivan Dmitrievich (RU) 2016-12-14 EP disclosed
US-20070098702-A1 Recombinant protein polymer vectors for systemic gene delivery UNIVERSITY OF MARYLAND, BALTIMORE 2007-05-03 US disclosed