Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.66 |
| ▸ | TP53 | P04637 | 6/20 | 0.66 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.66 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.57 |
| ▸ | MEN1 | O00255 | 3/20 | 0.57 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 4/20 | 0.42 |
| ▸ | RAB9A | P51151 | 4/20 | 0.42 |
| ▸ | PAX8 | Q06710 | 3/20 | 0.42 |
| ▸ | JAK2 | O60674 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | RNF4 | P78317 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4339458 | 0.91 | TP53 (0.60) | ALDH1A1TP53TDP1CYP3A4KMT2A | |
| Ethane SCHEMBL27359121 | 0.90 | ALDH1A1 (0.59) | ALDH1A1TP53TDP1CYP3A4KMT2A | |
| SCHEMBL8378909 | 0.87 | TDP1 (0.76) | ALDH1A1TP53TDP1CYP3A4KMT2A | |
| SCHEMBL31199167 | 0.87 | TP53 (0.50) | ALDH1A1TP53TDP1CYP3A4KMT2A | |
| SCHEMBL9614304 | 0.86 | ALDH1A1 (0.64) | ALDH1A1TP53TDP1CYP3A4KMT2A | |
| SCHEMBL11110577 | 0.86 | ALDH1A1 (0.51) | ALDH1A1TP53TDP1CYP3A4KMT2A | |
| SCHEMBL27352642 | 0.86 | TP53 (0.64) | ALDH1A1TP53TDP1CYP3A4KMT2A | |
| Ethane SCHEMBL6053657 | 0.85 | ALDH1A1 (0.63) | ALDH1A1TP53TDP1CYP3A4KMT2A | |
| SCHEMBL9420240 | 0.84 | TP53 (0.84) | ALDH1A1TP53TDP1CYP3A4KMT2A | |
| SCHEMBL9204317 | 0.84 | TP53 (0.50) | ALDH1A1TP53TDP1CYP3A4KMT2A |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102550582-A | Weeding composition and application thereof | HENAN JINTIANDI AGROCHEMICAL CO LTD | 2012-07-11 | — | — | CN | disclosed |
| CN-102461510-A | Mixed weeding composition containing bispyribac-sodium and pretilachlor | NANJING HUAZHOU PHARMACEUTICAL | 2012-05-23 | — | — | CN | disclosed |
| US-5055125-A | Thiocarbamates with dithiocarbamic acid derivatives | NITROKEMIA IPARTELEPEK (HU) | 1991-10-08 | — | — | US | disclosed |