Histidine

Histidine

SCHEMBL21768802

CC(C)CC(N)C(=O)O.NC(=O)CCC(N)C(=O)O.NC(CO)C(=O)O.NC(CO)C(=O)O.NC(Cc1c[nH]cn1)C(=O)O.NCCCCC(N)C(=O)O

nearest known ligand 0.37

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
GSR P00390 1/20 0.37
THRB P10828 1/20 0.36
ALOX15 P16050 1/20 0.35
BLM P54132 1/20 0.35
PMP22 Q01453 1/20 0.35
KMT2A Q03164 1/20 0.35
SLC7A5 Q01650 1/20 0.33
CPB1 P15086 1/20 0.32
CPB2 Q96IY4 1/20 0.32
ITGB3 P05106 1/20 0.31
ITGA2B P08514 1/20 0.31
ERAP2 Q6P179 2/20 0.31
ERAP1 Q9NZ08 2/20 0.31
LNPEP Q9UIQ6 2/20 0.31

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 SCHEMBL28378561 1.00 GSR (0.37) GSRTHRBALOX15BLMPMP22
Histidine SCHEMBL9220370 0.96 GSR (0.40) GSRTHRBALOX15BLMPMP22
Histidine SCHEMBL9211892 0.96 GSR (0.40) GSRTHRBALOX15BLMPMP22
Histidine SCHEMBL10379722 0.93 ALOX15 (0.40) GSRALOX15BLMPMP22KMT2A
Histidine SCHEMBL9750903 0.93 ALOX15 (0.40) GSRALOX15BLMPMP22KMT2A
Histidine SCHEMBL14691272 0.92 GSR (0.40) GSRTHRBSLC7A5CPB1CPB2
Histidine SCHEMBL14690885 0.92 GSR (0.40) GSRTHRBSLC7A5CPB1CPB2
Histidine SCHEMBL3791713 0.92 GSR (0.36) GSRTHRBALOX15BLMPMP22
Histidine SCHEMBL27806428 0.91 ALOX15 (0.38) GSRALOX15BLMPMP22KMT2A
Histidine SCHEMBL9750989 0.91 ALOX15 (0.38) ALOX15BLMPMP22KMT2ASLC7A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3617314-A1 OLIGONUCLEOTIDE DERIVATIVE OR SALT THEREOF Kyowa Kirin Co., Ltd. (JP) 2020-03-04 EP disclosed