Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 6/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | CES2 | O00748 | 2/20 | 0.42 |
| ▸ | CES1 | P23141 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.42 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.42 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.42 |
| ▸ | CHRNG | P07510 | 1/20 | 0.42 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.42 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.42 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL9219929 | 0.92 | CES2 (0.44) | ESR1SMN1; SMN2TSHRLMNACES2 | |
| SCHEMBL9221209 | 0.86 | CES2 (0.46) | SMN1; SMN2TSHRCES2CES1CHRNA1 | |
| SCHEMBL9219903 | 0.80 | CHRNA1 (0.55) | SMN1; SMN2LMNACES2CES1MAPK1 | |
| SCHEMBL7009800 | 0.76 | PIM1 (0.40) | ESR1SMN1; SMN2CYP1A2LMNACES2 | |
| SCHEMBL4714984 | 0.75 | KCNQ3 (0.38) | SMN1; SMN2TSHRCYP1A2SLC6A2SLC6A3 | |
| SCHEMBL9227046 | 0.74 | CHRNA1 (0.58) | SMN1; SMN2CES2CES1CHRNA1CHRNG | |
| SCHEMBL9226597 | 0.73 | CES2 (0.54) | SMN1; SMN2LMNACES2CES1MAPK1 | |
| SCHEMBL8469707 | 0.71 | MAOA (0.41) | ESR1SMN1; SMN2TSHRCYP1A2CYP2C19 | |
| SCHEMBL10630786 | 0.71 | HDAC1 (0.42) | SMN1; SMN2TSHRCYP1A2CYP2C19LMNA | |
| SCHEMBL9516567 | 0.70 | CES2 (0.59) | SMN1; SMN2CES2CES1CHRNA1CHRNG |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5093515-A | Intermediate for quinolone carboxylic acid bactericide | ASAHI GLASS COMPANY LTD. (JP) | 1992-03-03 | — | — | US | disclosed |
| US-5068449-A | FLUORINATED BENZOYL COMPOUNDS | ASAHI GLASS COMPANY, LTD. (JP) | 1991-11-26 | — | — | US | disclosed |