Benzene

Benzene

SCHEMBL8003017

CCCCCCCCCCCCC[Na].c1ccccc1

nearest known ligand 0.50

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.50
▸ THRB P10828 1/20 0.50
▸ CHRM2 P08172 2/20 0.44
▸ ADRA2A P08913 2/20 0.44
▸ ADORA3 P0DMS8 2/20 0.44
▸ CHRM1 P11229 2/20 0.44
▸ ACHE P22303 2/20 0.44
▸ SLC6A2 P23975 2/20 0.44
▸ SLC6A4 P31645 2/20 0.44
▸ SLC6A3 Q01959 2/20 0.44
▸ ABCB11 O95342 1/20 0.44
▸ ESR1 P03372 1/20 0.44
▸ PGR P06401 1/20 0.44
▸ HTR1A P08908 1/20 0.44
▸ DRD1 P21728 1/20 0.44
▸ TBXA2R P21731 1/20 0.44
▸ PTGS1 P23219 1/20 0.44
▸ PDE4A P27815 1/20 0.44
▸ ADRA1A P35348 1/20 0.44
▸ OPRM1 P35372 1/20 0.44

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
Benzene SCHEMBL50472 1.00 TSHR (0.50) TSHRTHRBCHRM2ADRA2AADORA3
Benzene SCHEMBL10625913 1.00 TSHR (0.50) TSHRTHRBCHRM2ADRA2AADORA3
SCHEMBL843476 0.90 TSHR (0.61) TSHRTHRBKMT2ALMNAMEN1
SCHEMBL2175713 0.90 — —
SCHEMBL2537565 0.90 TSHR (0.61) TSHRTHRBKMT2ALMNAMEN1
SCHEMBL2176487 0.90 TSHR (0.61) TSHRTHRBKMT2ALMNAMEN1
SCHEMBL1714429 0.90 TSHR (0.61) TSHRTHRBKMT2ALMNAMEN1
SCHEMBL3802440 0.90 TSHR (0.61) TSHRTHRBKMT2ALMNAMEN1
SCHEMBL10949694 0.90 TSHR (0.61) TSHRTHRBKMT2ALMNAMEN1
SCHEMBL816343 0.90 — —

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
US-6022673-A MIXTURE OF SILVER HALIDE PARTICLES, DEVELOPER, COUPLER AND BINDER FUJI PHOTO FILM CO., LTD. (JP) 2000-02-08 — — US disclosed
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