Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL5145133

Cc1ccccc1C(C)(C)N.N

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.43
ACHE P22303 2/20 0.43
GABRA1 P14867 1/20 0.41
GABRB2 P47870 1/20 0.41
CASR P41180 1/20 0.40
TDP1 Q9NUW8 2/20 0.39
CYP3A4 P08684 1/20 0.39
ALDH1A1 P00352 3/20 0.36
CA2 P00918 2/20 0.35
CA1 P00915 1/20 0.35
CA7 P43166 1/20 0.35
CA9 Q16790 1/20 0.35
TAAR1 Q96RJ0 2/20 0.34
SLC6A2 P23975 1/20 0.34
CYP2A6 P11509 2/20 0.32
CD44 P16070 1/20 0.32
TRPA1 O75762 1/20 0.32
ATM Q13315 1/20 0.32
CYP1A2 P05177 2/20 0.32

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
Bromide SCHEMBL28723982 0.98 TSHR (0.41) TSHRACHEGABRA1GABRB2CASR
SCHEMBL29581427 0.97 TSHR (0.45) TSHRACHEGABRA1GABRB2CASR
SCHEMBL164361 0.97 TSHR (0.45) TSHRACHEGABRA1GABRB2CASR
Fluoride SCHEMBL1502827 0.95 TSHR (0.43) TSHRACHEGABRA1GABRB2CASR
Bromide SCHEMBL21460045 0.95 TSHR (0.43) TSHRACHEGABRA1GABRB2CASR
Hydrochloric Acid SCHEMBL23886258 0.95 TDP1 (0.44) TSHRACHEGABRA1GABRB2CASR
Bromide SCHEMBL622796 0.95 TSHR (0.43) TSHRACHEGABRA1GABRB2CASR
Water SCHEMBL93584 0.95 TSHR (0.43) TSHRACHEGABRA1GABRB2CASR
Hydrochloric Acid SCHEMBL136350 0.95 TDP1 (0.44) TSHRACHEGABRA1GABRB2CASR
Iodide SCHEMBL1502892 0.95 TSHR (0.43) TSHRACHEGABRA1GABRB2CASR

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
US-7214757-B2 Polyurethane elastomers and shaped articles prepared therefrom EASTMAN KODAK COMPANY (US) 2007-05-08 US disclosed
US-20010046576-A1 Polyurethane elastomers and shaped articles prepared therefrom HEIDELBERG DIGITAL L.L.C. 2001-11-29 US disclosed
US-4762941-A POLYLACTAMS, MOLDING MATERIALS EASTMAN KODAK COMPANY (US) 1988-08-09 US disclosed
US-4729925-A ELECTROGRAPHY EASTMAN KODAK COMPANY (US) 1988-03-08 US disclosed