Lysine

Lysine

SCHEMBL7907063

CCN(c1sc(CC(C)C)cc1-c1ccc(Cn2c(OCC=O)cnc2-c2ccccc2)cc1)S(=O)(=O)C(N)=O.NCCCC[C@H](N)C(=O)O

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

PPARDPTGS1PTGS2dacAdacBdacCftsImrcAmrcBmrdA

The experimentally established mechanism targets of Lysine. 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
▸ MAS1 P04201 1/20 0.40
▸ AGTR2 P50052 15/20 0.34
▸ THRB P10828 1/20 0.32
▸ AGTR1 P30556 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ GMNN O75496 1/20 0.32
▸ USP2 O75604 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ NFKB1 P19838 1/20 0.32
▸ APEX1 P27695 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ THPO P40225 1/20 0.32
▸ MTOR P42345 1/20 0.32

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
Lysine SCHEMBL3906130 0.85 MAS1 (0.57) MAS1AGTR2AGTR1MEN1GMNN
Lysine SCHEMBL7907070 0.83 MAS1 (0.44) MAS1AGTR2THRBAGTR1MEN1
SCHEMBL1334131 0.76 MAS1 (0.66) MAS1AGTR2AGTR1MEN1GMNN
SCHEMBL4094539 0.75 MAS1 (0.65) MAS1AGTR2AGTR1MEN1GMNN
Lysine SCHEMBL3906133 0.68 MAS1 (0.63) MAS1AGTR2THRBAGTR1MEN1
Lysine SCHEMBL7800114 0.57 GSR (0.51) THRBKMT2A
SCHEMBL24019097 0.57 MAS1 (0.69) MAS1AGTR2AGTR1MEN1GMNN
SCHEMBL24637550 0.57 MAS1 (0.85) MAS1AGTR2AGTR1MEN1GMNN
SCHEMBL24637534 0.57 MAS1 (0.86) MAS1AGTR2AGTR1MEN1GMNN
Lysine SCHEMBL7800937 0.56 GSR (0.56) KMT2A

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
US-20010018449-A1 1-(p-thienylbenzyl)imidazoles as agonists of angiotensin (1-7) receptors, processes for their preparation, their use, and pharmaceutical preparations comprising them AVENTIS PHARMA DEUTSCHLAND GMBH 2001-08-30 — — 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 (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-20010018449-A1 1-(p-thienylbenzyl)imidazoles as agonists of angiotensin (1-7) receptors, processes for their preparation, their use, and pharmaceutical preparations comprising them AGTR1, NPR1, EDNRB MAS1 362/4885AGTR2 7/4885THRB 285/4885

“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.

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