Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL26679455

CCCCOc1c(C(=O)O)cc(CCCC)c(CCCC)c1CCCC.N

nearest known ligand 0.47

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 2/20 0.47
GABRD O14764 2/20 0.47
GABRA1 P14867 2/20 0.47
GABRB1 P18505 2/20 0.47
GABRG2 P18507 2/20 0.47
GABRB3 P28472 2/20 0.47
GABRA5 P31644 2/20 0.47
GABRA3 P34903 2/20 0.47
GABRA2 P47869 2/20 0.47
GABRB2 P47870 2/20 0.47
GABRA4 P48169 2/20 0.47
GABRE P78334 2/20 0.47
GABRA6 Q16445 2/20 0.47
GABRG1 Q8N1C3 2/20 0.47
GABRG3 Q99928 2/20 0.47
GABRQ Q9UN88 2/20 0.47
CNR2 P34972 1/20 0.43
THRA P10827 3/20 0.41
THRB P10828 3/20 0.41
KDM4E B2RXH2 1/20 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
SCHEMBL25435354 0.93 GABRP (0.46) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL25436761 0.89 GABRP (0.45) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL25438187 0.87 PLA2G2A (0.44) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL25437118 0.84 CNR2 (0.42) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL25435344 0.83 ALOX5 (0.41) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL25435791 0.83 GABRP (0.40) GABRPGABRDGABRA1GABRB1GABRG2
Ammonia Solution, Strong SCHEMBL29170066 0.83 GABRP (0.49) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL27460474 0.82 GABRP (0.43) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL25434965 0.82 GABRP (0.40) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL25437889 0.81 GABRP (0.41) GABRPGABRDGABRA1GABRB1GABRG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4279450-B1 METAL INTERCALATED POLYMERIC FULLERENE, TWO-DIMENSIONAL POLYMERIC FULLERENE AND PREPARATION METHOD THEREOF INST CHEMISTRY CAS (CN) 2024-10-30 EP disclosed
US-20230373790-A1 Two-dimensional polymeric fullerene and preparation method thereof INSTITUTE OF CHEMISTRY, CHINESE ACADEMY OF SCIENCES (CN) 2023-11-23 US disclosed
EP-4279450-A1 METAL INTERCALATED POLYMERIC FULLERENE, TWO-DIMENSIONAL POLYMERIC FULLERENE AND PREPARATION METHOD THEREOF INSTITUTE OF CHEMISTRY, CHINESE ACADEMY OF SCIENCES (CN) 2023-11-22 EP disclosed
CN-114956053-B Metal-doped polymer C 60 Two-dimensional polymerization of C 60 And preparation method 中国科学院化学研究所 2023-03-21 CN disclosed
CN-114702027-B Two-dimensional polymerization C 60 And method for preparing the same 中国科学院化学研究所 2023-02-03 CN disclosed
CN-114956053-A Metal-doped polymer C 60 Two-dimensional polymerization of C 60 And preparation method 中国科学院化学研究所 2022-08-30 CN disclosed
CN-114702027-A Two-dimensional polymerization C60And method for preparing the same 中国科学院化学研究所 2022-07-05 CN disclosed