2-(Aminomethyl)Phenol

2-(Aminomethyl)Phenol

SCHEMBL8025682

COc1ccc(Oc2cccc(C=O)c2)cc1.NCC(N)C(=O)O.NCc1ccccc1O

nearest known ligand 0.45

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A5 Q15758 4/20 0.45
GRIK1 P39086 2/20 0.43
GRIK2 Q13002 2/20 0.43
BACE1 P56817 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
EPOR P19235 2/20 0.40
KIF11 P52732 3/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
KMT2A Q03164 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TTR P02766 1/20 0.37
ALOX5 P09917 1/20 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
2-(Aminomethyl)Phenol SCHEMBL8025681 1.00 SLC1A5 (0.45) SLC1A5GRIK1GRIK2BACE1NPC1
2-(Aminomethyl)Phenol SCHEMBL7798293 0.90 NPC1 (0.46) SLC1A5BACE1NPC1RAB9ATDP1
Lysine SCHEMBL7802021 0.90 SLC1A5 (0.46) SLC1A5GRIK1GRIK2BACE1NPC1
Lysine SCHEMBL7802016 0.90 SLC1A5 (0.46) SLC1A5GRIK1GRIK2BACE1NPC1
2-(Aminomethyl)Phenol SCHEMBL8035202 0.87 KMO (0.44) SLC1A5NPC1RAB9AEPORMAOA
2-(Aminomethyl)Phenol SCHEMBL8035206 0.87 KMO (0.44) SLC1A5NPC1RAB9AEPORMAOA
2-(Aminomethyl)Phenol SCHEMBL7801377 0.83 EPOR (0.45) BACE1NPC1RAB9AEPORMAOA
Diaminopropanoic Acid SCHEMBL8035562 0.82 GRIK1 (0.59) SLC1A5GRIK1GRIK2NPC1RAB9A
Diaminopropanoic Acid SCHEMBL8035556 0.82 GRIK1 (0.59) SLC1A5GRIK1GRIK2NPC1RAB9A
Cyclohexylamine SCHEMBL8041423 0.80 GRIK1 (0.43) SLC1A5GRIK1GRIK2BACE1NPC1

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