Cyclohexylamine

Cyclohexylamine

SCHEMBL8035890

N#Cc1ccc(C=O)cc1.NC1CCCCC1.NCC(N)C(=O)O

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRIK1 P39086 1/20 0.45
▸ GRIK2 Q13002 1/20 0.45
▸ EPHX1 P07099 2/20 0.40
▸ DPP4 P27487 1/20 0.37
▸ FAP Q12884 1/20 0.37
▸ DPP8 Q6V1X1 1/20 0.37
▸ DPP9 Q86TI2 1/20 0.37
▸ DPP7 Q9UHL4 1/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ CTSC P53634 5/20 0.36
▸ KCNH2 Q12809 2/20 0.36
▸ KDM1A O60341 3/20 0.35
▸ ALDH1A1 P00352 3/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ TRPM8 Q7Z2W7 1/20 0.35
▸ PTGDR2 Q9Y5Y4 1/20 0.34
▸ LNPEP Q9UIQ6 1/20 0.34
▸ PKM P14618 1/20 0.34

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
Cyclohexylamine SCHEMBL8035887 1.00 GRIK1 (0.45) GRIK1GRIK2EPHX1DPP4FAP
Lysine SCHEMBL8041475 0.88 GSR (0.42) GRIK1GRIK2EPHX1DPP4FAP
Lysine SCHEMBL8041477 0.88 GSR (0.42) GRIK1GRIK2EPHX1DPP4FAP
Cyclohexylamine SCHEMBL8037502 0.88 TSHR (0.42) GRIK1GRIK2EPHX1DPP4FAP
Cyclohexylamine SCHEMBL8037499 0.88 TSHR (0.42) GRIK1GRIK2EPHX1DPP4FAP
Cyclohexylamine SCHEMBL7801498 0.87 NPC1 (0.41) GRIK1GRIK2EPHX1NPC1RAB9A
4-Hydroxybenzaldehyde SCHEMBL8037281 0.85 ALDH5A1 (0.41) GRIK1GRIK2NPC1RAB9AALDH1A1
4-Hydroxybenzaldehyde SCHEMBL8037276 0.85 ALDH5A1 (0.41) GRIK1GRIK2NPC1RAB9AALDH1A1
Benzaldehyde SCHEMBL8035694 0.85 KIF11 (0.42) GRIK1GRIK2ALDH1A1TRPM8PKM
Cyclohexylamine SCHEMBL8037696 0.84 GRIK1 (0.41) GRIK1GRIK2NPC1RAB9AALDH1A1

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-6127381-A A MELANOCORTIN RECEPTOR LIGAND FOR REGULATING FOOD INTAKE AND BODY WEIGHT, REGULATING CYTOKINE ACTIVITY, ANTI-INFLAMMATORY ACTIVITY LION BIOSCIENCE AG (DE) 2000-10-03 — — US disclosed
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