Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL4440047

CCc1cc(N(C)C)ccc1C(=O)O.N

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC16A3 O15427 1/20 0.45
ALDH1A1 P00352 6/20 0.42
KDM4E B2RXH2 3/20 0.42
PSMB5 P28074 1/20 0.41
GABRP O00591 2/20 0.41
GABRD O14764 2/20 0.41
GABRA1 P14867 2/20 0.41
GABRB1 P18505 2/20 0.41
GABRG2 P18507 2/20 0.41
GABRB3 P28472 2/20 0.41
GABRA5 P31644 2/20 0.41
GABRA3 P34903 2/20 0.41
GABRA2 P47869 2/20 0.41
GABRB2 P47870 2/20 0.41
GABRA4 P48169 2/20 0.41
GABRE P78334 2/20 0.41
GABRA6 Q16445 2/20 0.41
GABRG1 Q8N1C3 2/20 0.41
GABRG3 Q99928 2/20 0.41
GABRQ Q9UN88 2/20 0.41

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
SCHEMBL7601521 0.98 SLC16A3 (0.46) SLC16A3ALDH1A1KDM4EPSMB5GABRP
SCHEMBL41899 0.98 SLC16A3 (0.46) SLC16A3ALDH1A1KDM4EPSMB5GABRP
SCHEMBL29048779 0.90 MEN1 (0.53) SLC16A3ALDH1A1MEN1KMT2ASMN1; SMN2
Monoethanolamine SCHEMBL9339507 0.89 SLC16A3 (0.40) SLC16A3ALDH1A1KDM4EPSMB5GABRP
SCHEMBL9249843 0.88 SLC16A3 (0.40) SLC16A3ALDH1A1KDM4EPSMB5GABRP
SCHEMBL5387844 0.86 SLC16A3 (0.43) SLC16A3ALDH1A1KDM4EPSMB5GABRP
Anthranilic Acid SCHEMBL7069889 0.85 SMN1; SMN2 (0.42) SLC16A3ALDH1A1KDM4EGABRPGABRD
SCHEMBL7750610 0.85 PPARA (0.49) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL31406942 0.85 KMT2A (0.47) ALDH1A1KDM4EMEN1KMT2ASMN1; SMN2
SCHEMBL18315413 0.85 HPGD (0.64) ALDH1A1KDM4EMEN1KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160177453-A1 METHOD OF PHOTOPOLYMERIZING OF ACRYLATES QUALEX INC. 2016-06-23 US disclosed
US-9365658-B2 Method of photocuring acrylate compositions EASTMAN KODAK COMPANY (US) 2016-06-14 US disclosed
EP-2028240-B1 Phase change ink compositions XEROX CORP (US) 2016-02-10 EP disclosed
US-20150024141-A1 METHOD OF PHOTOCURING ACRYLATE COMPOSITIONS BANK OF AMERICA, N.A., AS AGENT 2015-01-22 US disclosed
EP-2028240-A1 Phase Change Ink Compositions Xerox Corporation (US) 2009-02-25 EP disclosed