Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.53 |
| ▸ | MAPT | P10636 | 5/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.53 |
| ▸ | NPC1 | O15118 | 3/20 | 0.53 |
| ▸ | TP53 | P04637 | 3/20 | 0.53 |
| ▸ | RAB9A | P51151 | 3/20 | 0.53 |
| ▸ | LMNA | P02545 | 3/20 | 0.53 |
| ▸ | HPGD | P15428 | 3/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | STAT1 | P42224 | 1/20 | 0.53 |
| ▸ | MBTD1 | Q05BQ5 | 1/20 | 0.50 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 5/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.49 |
| ▸ | RELA | Q04206 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| Phenol SCHEMBL28272307 | 0.94 | MAPT (0.56) | ALDH1A1MAPTL3MBTL1HSD17B10ALOX15 | |
| Cyclohexane SCHEMBL27743405 | 0.89 | L3MBTL1 (0.59) | ALDH1A1MAPTL3MBTL1HSD17B10ALOX15 | |
| SCHEMBL2312380 | 0.89 | L3MBTL1 (0.59) | ALDH1A1MAPTL3MBTL1HSD17B10ALOX15 | |
| Benzene SCHEMBL28818227 | 0.89 | L3MBTL1 (0.59) | ALDH1A1MAPTL3MBTL1HSD17B10ALOX15 | |
| SCHEMBL1968506 | 0.89 | L3MBTL1 (0.59) | ALDH1A1MAPTL3MBTL1HSD17B10ALOX15 | |
| SCHEMBL93630 | 0.89 | L3MBTL1 (0.59) | ALDH1A1MAPTL3MBTL1HSD17B10ALOX15 | |
| SCHEMBL8542780 | 0.89 | L3MBTL1 (0.59) | ALDH1A1MAPTL3MBTL1HSD17B10ALOX15 | |
| SCHEMBL28105340 | 0.89 | L3MBTL1 (0.59) | ALDH1A1MAPTL3MBTL1HSD17B10ALOX15 | |
| Water SCHEMBL10922019 | 0.86 | L3MBTL1 (0.57) | ALDH1A1MAPTL3MBTL1HSD17B10ALOX15 | |
| Hydrochloric Acid SCHEMBL5417163 | 0.86 | ALDH1A1 (0.60) | ALDH1A1MAPTL3MBTL1HSD17B10ALOX15 |
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-109810047-A | (R) synthetic method of the chiral intermediate of -3- Phenylpiperidine or/and (S) -3- Phenylpiperidine and Ni Lapani | 上海博邦医药科技有限公司 | 2019-05-28 | — | — | CN | disclosed |
| CN-107141840-B | Near-infrared high-quantum-yield dye and preparation and application thereof | 中国科学院理化技术研究所 | 2019-03-12 | — | — | CN | disclosed |