Methamphetamine

Methamphetamine

SCHEMBL6462456

CNC(C)Cc1ccccc1.N[C@@H](CC(=O)O)C(=O)O

nearest known ligand 0.62

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SLC6A2SLC6A3SLC6A4

The experimentally established mechanism targets of Methamphetamine. 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
TAAR1 Q96RJ0 2/20 0.62
SLC18A2 Q05940 1/20 0.62
SIGMAR1 Q99720 1/20 0.62
ALPI P09923 1/20 0.56
PKM P14618 1/20 0.56
PTGS1 P23219 1/20 0.56
XIAP P98170 1/20 0.56
SLC7A5 Q01650 1/20 0.56
SLC1A3 P43003 3/20 0.53
SLC1A2 P43004 3/20 0.53
SLC1A1 P43005 3/20 0.53
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
LTA4H P09960 2/20 0.49
CPA1 P15085 2/20 0.49
CPB1 P15086 1/20 0.49
CPA3 P15088 1/20 0.49
CPB2 Q96IY4 1/20 0.49
ANPEP P15144 1/20 0.48
RNPEP Q9H4A4 1/20 0.48

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
Methamphetamine SCHEMBL6462454 1.00 TAAR1 (0.62) TAAR1SLC18A2SIGMAR1ALPIPKM
Methamphetamine SCHEMBL6456321 0.96 TAAR1 (0.57) TAAR1SLC18A2SIGMAR1ALPIPKM
Methamphetamine SCHEMBL6456330 0.96 TAAR1 (0.57) TAAR1SLC18A2SIGMAR1ALPIPKM
Aspartic Acid SCHEMBL29223446 0.85 ALPI (0.56) ALPIPKMPTGS1XIAPSLC7A5
Levamfetamine SCHEMBL4596702 0.84 SLC6A2 (0.63) TAAR1SIGMAR1ALPIPKMPTGS1
Dextroamphetamine SCHEMBL3681578 0.84 SLC6A2 (0.63) TAAR1SIGMAR1ALPIPKMPTGS1
Amphetamine SCHEMBL1030967 0.84 SLC6A2 (0.63) TAAR1SIGMAR1ALPIPKMPTGS1
Amphetamine SCHEMBL1030966 0.84 SLC6A2 (0.63) TAAR1SIGMAR1ALPIPKMPTGS1
Phenylalanine SCHEMBL17766088 0.83 SLC7A5 (0.71) ALPIPKMPTGS1XIAPSLC7A5
Dextroamphetamine SCHEMBL21158800 0.83 SLC6A2 (0.61) TAAR1SIGMAR1ALPIPKMPTGS1

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-20050159419-A1 Compositions of a cyclooxygenase-2 selective inhibitor and a central nervous system stimulant for the treatment of central nervous system damage PHARMACIA CORPORATION (US) 2005-07-21 US disclosed
WO-2004103283-A2 COMPOSITIONS OF A CYCLOOXYGENASE-2 SELECTIVE INHIBITOR AND A CENTRAL NERVOUS SYSTEM STIMULANT FOR THE TREATMENT OF CENTRAL NERVOUS SYSTEM DAMAGE PHARMACIA CORPORATION (US) 2004-12-02 WO disclosed
US-20040176378-A1 Compositions of a cyclooxygenase-2 selective inhibitor and an amphetamine for the treatment of reduced blood flow to the central nervous system PHARMACIA CORPORATION 2004-09-09 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-20050159419-A1 Compositions of a cyclooxygenase-2 selective inhibitor and a central nervous system stimulant for the treatment of central nervous system damage GAP43, PTGS2, CNR2 TAAR1 54/4885SLC18A2 252/4885SIGMAR1 951/4885
US-20040176378-A1 Compositions of a cyclooxygenase-2 selective inhibitor and an amphetamine for the treatment of reduced blood flow to the central nervous system HTR2C, HTR2A, PTGS2 TAAR1 72/4885SLC18A2 321/4885SIGMAR1 737/4885

“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.