Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTRC | Q99895 | 3/20 | 0.47 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | BCL2 | P10415 | 1/20 | 0.43 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.42 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.42 |
| ▸ | FEN1 | P39748 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3301733 | 0.83 | PNMT (0.56) | CTRCCALM1MEN1KMT2ACYP3A4 | |
| SCHEMBL4465598 | 0.81 | CYP3A4 (0.43) | MEN1KMT2ACYP3A4HPGDALOX15 | |
| SCHEMBL11403614 | 0.79 | CALM1 (0.52) | CTRCCALM1MEN1KMT2ACYP3A4 | |
| SCHEMBL28135147 | 0.77 | CTRC (0.40) | CTRCCALM1MEN1KMT2ACYP3A4 | |
| SCHEMBL11520705 | 0.76 | PNMT (0.58) | MEN1KMT2ACYP3A4ALDH1A1P2RX7 | |
| SCHEMBL27538653 | 0.75 | CTRC (0.49) | CTRCCALM1MEN1KMT2ACYP3A4 | |
| SCHEMBL10732241 | 0.75 | LTA4H (0.44) | CTRCALDH1A1 | |
| SCHEMBL4423210 | 0.75 | SIGMAR1 (0.53) | CTRCCALM1MEN1KMT2ACYP3A4 | |
| Ammonia Solution, Strong SCHEMBL3291590 | 0.74 | CTRC (0.47) | CTRCCALM1MEN1KMT2ACYP3A4 | |
| SCHEMBL10817061 | 0.74 | CYP2A6 (0.50) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115403461-B | Method for synthesizing benzoic acid by oxidizing ethylbenzene | 吕梁学院 | 2023-09-22 | — | — | CN | disclosed |
| CN-115403461-A | Method for synthesizing benzoic acid by oxidizing ethylbenzene | 吕梁学院 | 2022-11-29 | — | — | CN | disclosed |
| CN-109970544-B | Device and method for preparing benzoic acid from toluene | 中北大学 | 2021-07-02 | — | — | CN | disclosed |
| CN-110026145-B | Hypergravity reaction device and application thereof | 中北大学 | 2021-05-18 | — | — | CN | disclosed |
| WO-2010016620-A1 | SURFACE TREATING AGENT FOR COPPER OR COPPER ALLOY AND USE THEREOF | SHIKOKU CHEMICALS CORPORATION (JP) | 2010-02-11 | — | — | WO | disclosed |