Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.39 |
| ▸ | PTPRC | P08575 | 1/20 | 0.38 |
| ▸ | S100A4 | P26447 | 1/20 | 0.38 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL27783994 | 0.76 | HPGD (0.47) | HPGDALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL9524433 | 0.75 | VCAM1 (0.50) | CYP1A2ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL12985610 | 0.75 | ALDH1A1 (0.49) | HPGDCYP1A2ALDH1A1MAPTMEN1 | |
| SCHEMBL4690726 | 0.75 | CYP1A2 (0.60) | CYP1A2ALDH1A1MEN1KMT2AMAPK1 | |
| SCHEMBL27869963 | 0.75 | HPGD (0.46) | HPGDCYP1A2ALDH1A1MAPTMEN1 | |
| SCHEMBL7680328 | 0.74 | ALDH1A1 (0.46) | HPGDCYP1A2ALDH1A1MAPTMEN1 | |
| SCHEMBL7680313 | 0.74 | ALDH1A1 (0.46) | HPGDCYP1A2ALDH1A1MAPTMEN1 | |
| Benzene SCHEMBL28064387 | 0.73 | HPGD (0.60) | HPGDALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL16268196 | 0.71 | GPR35 (0.48) | CYP1A2ALDH1A1MAPTL3MBTL1TDP1 | |
| SCHEMBL29962795 | 0.71 | HPGD (0.62) | HPGDALDH1A1MAPTMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-105111148-A | 2-[(N-para-chlorophenyl)-3-pyrazole oxymethyl]nitrobenzene and preparation method therefor and application thereof | ANHUI COSTAR BIO CHEMICAL CO LTD | 2015-12-02 | — | — | CN | claimed |
| CN-105111148-A | 2-[(N-para-chlorophenyl)-3-pyrazole oxymethyl]nitrobenzene and preparation method therefor and application thereof | ANHUI COSTAR BIO CHEMICAL CO LTD | 2015-12-02 | — | — | CN | disclosed |