Histamine

Histamine

SCHEMBL4064919

NCCc1c[nH]cn1.c1ccc(C(OC(c2ccccc2)c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

HRH1

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

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH1 known ✓ P35367 4/20 0.38
HTR1B P28222 1/20 0.38
KCNH2 Q12809 1/20 0.33
HRH4 Q9H3N8 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
AKT2 P31751 1/20 0.33
HTR2A P28223 3/20 0.32
TAAR1 Q96RJ0 2/20 0.32
CYP2A6 P11509 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
LOXL2 Q9Y4K0 1/20 0.32
IDO1 P14902 1/20 0.30
TDO2 P48775 1/20 0.30
GRIN2D O15399 1/20 0.30
GRIN3B O60391 1/20 0.30
GRIN1 Q05586 1/20 0.30
GRIN2A Q12879 1/20 0.30
GRIN2B Q13224 1/20 0.30
GRIN2C Q14957 1/20 0.30
GRIN3A Q8TCU5 1/20 0.30

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
Histamine SCHEMBL28074178 0.82 HRH1 (0.42) HRH1HTR1BHRH4HRH3HTR2A
Histamine SCHEMBL9846382 0.80 HRH1 (0.43) HRH1HTR1BHRH4HRH3HTR2A
Histamine SCHEMBL4234179 0.79 HRH4 (0.39) HRH1HRH4HRH3HTR2ATAAR1
Histamine SCHEMBL1668636 0.79 HRH4 (0.42) HRH1HRH4HRH3SMN1; SMN2LOXL2
Histamine SCHEMBL27340939 0.79
Histamine SCHEMBL2279 0.79
Histamine SCHEMBL289072 0.79 HRH4 (0.42) HRH1HRH4HRH3SMN1; SMN2LOXL2
Histamine SCHEMBL7444650 0.79 HRH4 (0.42) HRH1HRH4HRH3SMN1; SMN2LOXL2
Histamine SCHEMBL5447892 0.79
Histamine SCHEMBL8571326 0.78 HRH1 (0.42) HRH1HTR1BHRH4HRH3HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090203763-A1 SUBSTITUTED BENZHYDRYLETHERS AUSPEX PHARMACEUTICALS, INC. (US) 2009-08-13 US disclosed
WO-2009094457-A2 SUBSTITUTED BENZHYDRYLETHERS AUSPEX PHARMACEUTICALS (US) 2009-07-30 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090203763-A1 SUBSTITUTED BENZHYDRYLETHERS UGT2B7, CYP3A7, CYP3A43 HRH1 265/4885HTR1B 1304/4885KCNH2 669/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.