Alanine

Alanine

SCHEMBL3438701

CC(N)C(=O)O.OCC(O)CO

nearest known ligand 0.47

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
OR51E2 Q9H255 1/20 0.43
TP53 P04637 1/20 0.43
USP2 O75604 1/20 0.43
SLCO1B1 Q9Y6L6 1/20 0.43
SLC7A5 Q01650 2/20 0.42
SLC1A1 P43005 2/20 0.39
THRB P10828 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
SLC1A3 P43003 1/20 0.38
SLC1A2 P43004 1/20 0.38
LTA4H P09960 1/20 0.38
GABRP O00591 2/20 0.37
GABRD O14764 2/20 0.37
GABRA1 P14867 2/20 0.37
GABRB1 P18505 2/20 0.37
GABRG2 P18507 2/20 0.37
GABRB3 P28472 2/20 0.37
GABRA5 P31644 2/20 0.37

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
Alanine SCHEMBL2781385 1.00 ALDH1A1 (0.47) ALDH1A1LMNAOR51E2TP53USP2
Alanine SCHEMBL15323960 0.87 OR51E2 (0.40) ALDH1A1LMNAOR51E2TP53USP2
Alanine SCHEMBL15322553 0.87 PAX8 (0.41) ALDH1A1LMNAOR51E2TP53USP2
Alanine SCHEMBL20610135 0.86 SLC22A6 (0.50) LMNAOR51E2USP2SLCO1B1TDP1
Alanine SCHEMBL15323596 0.84 TDP1 (0.53) OR51E2TP53USP2SLCO1B1SLC7A5
Alanine SCHEMBL15323593 0.84 TDP1 (0.53) OR51E2TP53USP2SLCO1B1SLC7A5
Glycerin SCHEMBL11364524 0.83 LMNA (0.53) ALDH1A1LMNAOR51E2TP53USP2
Glycerin SCHEMBL1838800 0.83 LMNA (0.53) ALDH1A1LMNAOR51E2TP53USP2
Lactic Acid SCHEMBL15512248 0.83 TP53 (0.65) ALDH1A1LMNAOR51E2TP53USP2
Glycerin SCHEMBL2442337 0.83 LMNA (0.53) ALDH1A1LMNAOR51E2TP53USP2

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6506384-B1 Assaying biological fluid sample from subject having symptoms of active tuberculosis for presence of early antibodies specific for a 27 kDa mycobacterial tuberculosis protein named MPT51 NEW YORK UNIVERSITY 2003-01-14 US claimed
US-6245331-B1 Early detection of mycobacterial disease NEW YORK UNIV. MEDICAL CENTER 2001-06-12 US claimed
CN-108865918-B Method for marking viable gram-positive bacteria and cell walls thereof 中国科学院微生物研究所 2022-01-07 CN disclosed
CN-108865918-A A method of the gram-positive bacterium of label survival and its cell wall 中国科学院微生物研究所 2018-11-23 CN disclosed
CN-105579064-B The active Inhibitors of anti-acid fast bacteria medicine, the screening technique of anti-acid fast bacteria medicine and WecA and its ortholog are used in combination 公益财团法人微生物化学研究会 2018-11-13 CN disclosed
CN-108348510-A Benzylamine-containing heterocyclic compounds and compositions useful against mycobacterial infections M·J·米勒 2018-07-31 CN disclosed
CN-105579064-A Combined anti-acid-fast bacterial agent, screening method for anti-acid-fast bacterial agents, and activity inhibitor of WecA or ortholog thereof MICROBIAL CHEM RES FOUND 2016-05-11 CN disclosed
EP-1567266-B1 INTEGRATED SOLID-PHASE HYDROPHILIC MATRIX CIRCUITS AND MICRO-ARRAYS EPOCAL INC (CA) 2015-10-28 EP disclosed
US-7807182-B2 Early detection of mycobacterial disease using peptides COLORADO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2010-10-05 US disclosed
US-20090280140-A1 Early detection of mycobacterial disease using peptides COLORADO STATE UNIVERSITY RESEARCH FOUNDATION 2009-11-12 US disclosed
US-7201833-B2 Integrated solid-phase hydrophilic matrix circuits and micro-arrays EPOCAL INC. (CA) 2007-04-10 US disclosed
EP-0952849-A4 EARLY DETECTION OF MYCOBACTERIAL DISEASE UNIV NEW YORK (US) 2004-09-08 EP disclosed
WO-2004050243-A1 INTEGRATED SOLID-PHASE HYDROPHILIC MATRIX CIRCUITS AND MICRO-ARRAYS EPOCAL INC. (CA) 2004-06-17 WO disclosed
US-20030127333-A1 Integrated solid-phase hydrophilic matrix circuits and micro-arrays SIEMENS HEALTHCARE DIAGNOSTICS INC. 2003-07-10 US disclosed
WO-2003012395-A2 EARLY DETECTION OF MYCOBACTERIAL DISEASE USING PEPTIDES NEW YORK UNIVERSITY (US) 2003-02-13 WO disclosed
US-6506384-B1 Assaying biological fluid sample from subject having symptoms of active tuberculosis for presence of early antibodies specific for a 27 kDa mycobacterial tuberculosis protein named MPT51 NEW YORK UNIVERSITY 2003-01-14 US disclosed
US-6245331-B1 Early detection of mycobacterial disease NEW YORK UNIV. MEDICAL CENTER 2001-06-12 US disclosed
EP-0952849-A1 EARLY DETECTION OF MYCOBACTERIAL DISEASE NEW YORK UNIVERSITY (US) 1999-11-03 EP disclosed
WO-1998029132-A9 EARLY DETECTION OF MYCOBACTERIAL DISEASE 1998-10-29 WO disclosed
WO-1998029132-A1 EARLY DETECTION OF MYCOBACTERIAL DISEASE NEW YORK UNIVERSITY (US) 1998-07-09 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-20090280140-A1 Early detection of mycobacterial disease using peptides MICA, TAP1, TMEM41B ALDH1A1 4659/4885LMNA 3830/4885OR51E2 942/4885

“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.