Tridecane

Tridecane

SCHEMBL27396019

C1CNCCNCCNCCN1.CCCCCCCCCCCCC

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.57
THRB P10828 1/20 0.57
GNAI3 P08754 7/20 0.48
GNAO1 P09471 7/20 0.48
GNAI1 P63096 7/20 0.48
HIF1A Q16665 1/20 0.43
MAPT P10636 1/20 0.43
PDE4A P27815 1/20 0.43
KDR P35968 1/20 0.43
DNM1 Q05193 4/20 0.42
ALDH1A1 P00352 2/20 0.42
LMNA P02545 2/20 0.42
HSD17B10 Q99714 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42

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
Decane SCHEMBL27463252 1.00 TSHR (0.57) TSHRTHRBGNAI3GNAO1GNAI1
Nonane SCHEMBL27394311 1.00 TSHR (0.57) TSHRTHRBGNAI3GNAO1GNAI1
Tetradecane SCHEMBL27500186 1.00 TSHR (0.57) TSHRTHRBGNAI3GNAO1GNAI1
Octane SCHEMBL11308877 1.00 TSHR (0.57) TSHRTHRBGNAI3GNAO1GNAI1
Decane SCHEMBL28285911 1.00 TSHR (0.57) TSHRTHRBGNAI3GNAO1GNAI1
Heptane SCHEMBL27336545 1.00 TSHR (0.57) TSHRTHRBGNAI3GNAO1GNAI1
Nonane SCHEMBL10873465 1.00 TSHR (0.57) TSHRTHRBGNAI3GNAO1GNAI1
Heptane SCHEMBL27839638 0.97 TSHR (0.53) TSHRTHRBGNAI3GNAO1GNAI1
Heptane SCHEMBL28830202 0.96 TSHR (0.61) TSHRTHRBGNAI3GNAO1GNAI1
Piperazine SCHEMBL27708668 0.96 TSHR (0.50) TSHRTHRBGNAI3GNAO1GNAI1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1997671-A Peptide Purification by Hard Metal Ion Affinity Chromatography NOVO NORDISK AS (DK) 2007-07-11 CN claimed
CN-1222147-A Process for preparation of tetraazamacrocycles BRACCO SPA (IT) 1999-07-07 CN claimed
CN-105073144-A Process for producing a complex of a lanthanide with a macrocyclic ligand AGFA HEALTHCARE NV 2015-11-18 CN disclosed
CN-1997671-B Peptide Purification by Hard Metal Ion Affinity Chromatography NOVO NORDISK AS 2012-07-18 CN disclosed
CN-101516899-A Compositions and methods for cellular imaging and therapy UNIV TEXAS (US) 2009-08-26 CN disclosed
CN-1997671-A Peptide Purification by Hard Metal Ion Affinity Chromatography NOVO NORDISK AS (DK) 2007-07-11 CN disclosed
CN-1083442-C Process for prepn. of tetraazamacrocycles BRACCO SPA (IT) 2002-04-24 CN disclosed
CN-1222147-A Process for preparation of tetraazamacrocycles BRACCO SPA (IT) 1999-07-07 CN disclosed