Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL28869774

Cc1cccc(CC(C)CS(=O)(=O)O)n1.N

nearest known ligand 0.35

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.35
▸ POLB P06746 1/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ OPRM1 P35372 1/20 0.35
▸ OPRD1 P41143 1/20 0.35
▸ P2RX7 Q99572 1/20 0.34
▸ RAB9A P51151 3/20 0.34
▸ NPC1 O15118 2/20 0.34
▸ ALDH1A1 P00352 3/20 0.33
▸ KDM4E B2RXH2 3/20 0.33
▸ HPGD P15428 3/20 0.33
▸ FAAH O00519 1/20 0.33
▸ KEAP1 Q14145 1/20 0.33
▸ NFE2L2 Q16236 1/20 0.33
▸ PDE8B O95263 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ CCR1 P32246 1/20 0.32
▸ CCR8 P51685 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ HSD17B10 Q99714 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
SCHEMBL17489037 0.77 KDM4E (0.44) KMT2AMEN1OPRM1OPRD1P2RX7
SCHEMBL8995830 0.73 NOS2 (0.46) KMT2APOLBMEN1OPRM1OPRD1
SCHEMBL23343777 0.73 NOS2 (0.46) KMT2APOLBMEN1OPRM1OPRD1
SCHEMBL2614966 0.73 KDM4E (0.46) KMT2APOLBMEN1OPRM1OPRD1
SCHEMBL23153062 0.72 CCR1 (0.38) KMT2APOLBMEN1OPRM1OPRD1
SCHEMBL20897039 0.70 TAAR1 (0.47) PDE8BCCR1CCR8
SCHEMBL22373334 0.69 KMT2A (0.40) KMT2APOLBMEN1OPRM1OPRD1
Sulfuric Acid SCHEMBL4275336 0.68 CCR1 (0.52) KMT2AMEN1P2RX7RAB9AALDH1A1
SCHEMBL27964879 0.68 RAB9A (0.43) KMT2APOLBMEN1OPRM1OPRD1
Ammonia Solution, Strong SCHEMBL28869780 0.68 HRH3 (0.38) KMT2APOLBMEN1RAB9ANPC1

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
CN-112570022-B Magnetic substance immobilized organic-inorganic hybrid material catalyst and preparation and application thereof 浙江工商大学 2022-09-20 — — CN disclosed
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