Isopropylamine

Isopropylamine

SCHEMBL7770700

CC(C)N.CNC.CNC.N#CP(=O)(O)O.N#CP(=O)(O)O

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LAP3 P28838 4/20 0.39
ANPEP P15144 5/20 0.38
ALDH1A1 P00352 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
ERAP1 Q9NZ08 1/20 0.34
FDPS P14324 1/20 0.32
DPP4 P27487 1/20 0.31
METAP1 P53582 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
MMP1 P03956 1/20 0.31
MMP2 P08253 1/20 0.31
MMP9 P14780 1/20 0.31
MMP8 P22894 1/20 0.31
CA9 Q16790 1/20 0.31

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
Isopropylamine SCHEMBL7569273 0.92 LAP3 (0.43) LAP3ANPEPALDH1A1TDP1ERAP1
Isopropylamine SCHEMBL8424291 0.92 LAP3 (0.43) LAP3ANPEPALDH1A1TDP1ERAP1
Isopropylamine SCHEMBL7572409 0.92 LAP3 (0.43) LAP3ANPEPALDH1A1TDP1ERAP1
Dimethylamine SCHEMBL8425216 0.87 MMP2 (0.36) CA2MMP2MMP8
Dimethylamine SCHEMBL7571945 0.87 MMP2 (0.36) CA2MMP2MMP8
SCHEMBL176547 0.74
SCHEMBL28227855 0.72 TP53 (0.36) LAP3ANPEPCA12CA1CA2
Ammonia Solution, Strong SCHEMBL7569939 0.71
Phosphoric Acid SCHEMBL7579299 0.71 CA2 (0.33) CA2
SCHEMBL7571332 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2001507695-A 2001-06-12 JP claimed
EP-0948507-A1 HYDROGENATION OF CYANOPHOSPHONATE DERIVATIVES MONSANTO COMPANY (US) 1999-10-13 EP claimed
US-5905163-A REDUCTION OF CYANO GROUP BY CATALYTIC HYDROGENATION MONSANTO COMPANY (US) 1999-05-18 US claimed
WO-1998029423-A1 HYDROGENATION OF CYANOPHOSPHONATE DERIVATIVES MONSANTO COMPANY (US) 1998-07-09 WO claimed