Phosphine

Phosphine

SCHEMBL27770571

C1CCC1.O=S(=O)(O)c1ccccc1.P

nearest known ligand 0.80

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Known targets — ChEMBL curated mechanism

BTKCACNA1CCACNA1DCACNA1FCACNA1SCACNA2D1CACNA2D2DRD2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQHRH1HTR2AP2RY12

The experimentally established mechanism targets of Phosphine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.80
SMN1; SMN2 Q16637 2/20 0.80
POLB P06746 2/20 0.54
CYP2D6 P10635 1/20 0.54
LMNA P02545 3/20 0.48
HTR6 P50406 1/20 0.48
HPGD P15428 1/20 0.47
ALDH1A1 P00352 8/20 0.47
NT5E P21589 1/20 0.46
CYP2C19 P33261 1/20 0.46
HTT P42858 2/20 0.46
GAA P10253 1/20 0.45
MCOLN3 Q8TDD5 1/20 0.45
HSD17B10 Q99714 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
NAPRT Q6XQN6 1/20 0.45
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
MMP1 P03956 1/20 0.44
MMP2 P08253 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
Cyclohexane SCHEMBL18585697 0.97 TSHR (0.84) TSHRSMN1; SMN2POLBCYP2D6LMNA
Cyclopropane SCHEMBL2101078 0.97 TSHR (0.84) TSHRSMN1; SMN2POLBCYP2D6LMNA
Phosphine SCHEMBL1050309 0.92 TSHR (0.94) TSHRSMN1; SMN2POLBCYP2D6LMNA
Phosphine SCHEMBL27554699 0.92 TSHR (0.94) TSHRSMN1; SMN2POLBCYP2D6LMNA
SCHEMBL30812783 0.89 TSHR (1.00) TSHRSMN1; SMN2POLBCYP2D6LMNA
SCHEMBL30671620 0.89 TSHR (1.00) TSHRSMN1; SMN2POLBCYP2D6LMNA
SCHEMBL30307036 0.89 TSHR (1.00) TSHRSMN1; SMN2POLBCYP2D6LMNA
SCHEMBL597672 0.89 TSHR (1.00) TSHRSMN1; SMN2POLBCYP2D6LMNA
SCHEMBL3409457 0.89 TSHR (1.00) TSHRSMN1; SMN2POLBCYP2D6LMNA
SCHEMBL2509 0.89 TSHR (1.00) TSHRSMN1; SMN2POLBCYP2D6LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102558810-B Polycarbonate resin composition and molded product formed of the same CHEIL IND INC 2014-09-24 CN disclosed
CN-102558810-A Polycarbonate resin composition and molded product formed of the same CHEIL IND INC 2012-07-11 CN disclosed
CN-100519654-C Polycarbonate resin composition and molded article thereof IDEMITSU PETROCHEMICAL CO (JP) 2009-07-29 CN disclosed