Halothane

Halothane

SCHEMBL1612295

FC(F)(F)C(Cl)Br.FC(F)(F)C(Cl)Br

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGLRA1GLRBKCNK10KCNK18KCNK2KCNK3KCNK9

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

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 1.00
ALDH1A1 P00352 1/20 1.00
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35

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
Halothane SCHEMBL443681 1.00
Halothane SCHEMBL337605 1.00
Halothane SCHEMBL25588 1.00
Halothane SCHEMBL1295253 0.96
Halothane SCHEMBL5961792 0.96 HSD17B10 (0.92) HSD17B10ALDH1A1MEN1KMT2A
Halothane SCHEMBL15475924 0.92
Halothane SCHEMBL6289622 0.92
Halothane SCHEMBL8902191 0.89 HSD17B10 (0.79) HSD17B10ALDH1A1MEN1KMT2A
Halothane SCHEMBL10725043 0.89
Halothane SCHEMBL9138026 0.80 ALDH1A1 (0.65) HSD17B10ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102006860-B Pharmaceutical composition containing permethylated cyclodextrin BROSCHEIT JENS 2012-12-19 CN disclosed
US-20110086037-A1 METHOD OF TREATING INFLAMMATORY DISORDERS ILIICH EPSHTEIN OLEG 2011-04-14 US disclosed
CN-102006860-A Pharmaceutical composition containing permethylated cyclodextrin JENS BROSCHEIT 2011-04-06 CN disclosed
US-20080081801-A1 PORPHYRIN OXYGEN INFUSION FOR INCREASING CONCENTRATIONS IN TUMOR TISSUES TSUCHIDA EISHUN 2008-04-03 US disclosed
US-20050222116-A1 Porphyrin oxygen infusion preparation for increasing oxygen concentration in tumor tissue NIPRO CORPORATION (JP) 2005-10-06 US disclosed
EP-1512399-A1 PORPHYRIN OXYGEN INFUSION PREPARATION FOR INCREASING OXYGEN CONCENTRATION IN TUMOR TISSUE Nipro Corporation (JP) 2005-03-09 EP disclosed
US-5173432-A Apparatus and method for measuring the concentration or partial pressure of oxygen THE DOW CHEMICAL COMPANY (US) 1992-12-22 US 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 (2 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-20080081801-A1 PORPHYRIN OXYGEN INFUSION FOR INCREASING CONCENTRATIONS IN TUMOR TISSUES ALB, PPOX, PPIF HSD17B10 3402/4885ALDH1A1 2830/4885MEN1 1849/4885
US-20050222116-A1 Porphyrin oxygen infusion preparation for increasing oxygen concentration in tumor tissue ALB, PPOX, PPIF HSD17B10 3670/4885ALDH1A1 3147/4885MEN1 2329/4885

“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.