Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 2/20 | 0.52 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.44 |
| ▸ | MAOB | P27338 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA3 | P07451 | 1/20 | 0.38 |
| ▸ | CA6 | P23280 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13053842 | 0.77 | AGXT (0.48) | CYP2A6RAB9AMAOBNPC1SMN1; SMN2 | |
| SCHEMBL1534961 | 0.77 | CYP2A6 (0.59) | CYP2A6RAB9ALOXL2MAOBNPC1 | |
| SCHEMBL17232544 | 0.77 | CYP2A6 (0.42) | CYP2A6RAB9ALOXL2MAOBNPC1 | |
| SCHEMBL31591478 | 0.76 | CYP2A6 (0.44) | CYP2A6RAB9ALOXL2MAOBALDH1A1 | |
| SCHEMBL25329970 | 0.76 | TRPA1 (0.34) | TSHRALDH1A1 | |
| SCHEMBL5953661 | 0.76 | IDO1 (0.47) | MAOBKMT2AALDH1A1CA12CA2 | |
| SCHEMBL4053548 | 0.76 | APP (0.43) | RAB9ALOXL2MAOBSMN1; SMN2L3MBTL1 | |
| SCHEMBL28586895 | 0.76 | MAOB (0.47) | CYP2A6RAB9ALOXL2MAOBNPC1 | |
| SCHEMBL1450921 | 0.75 | TSHR (0.46) | MAOBL3MBTL1TSHRALDH1A1CA2 | |
| SCHEMBL13863253 | 0.73 | APP (0.49) | RAB9ANPC1SMN1; SMN2L3MBTL1TSHR |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112186251-A | Non-aqueous electrolyte of lithium ion battery and lithium ion battery | 香河昆仑化学制品有限公司 | 2021-01-05 | — | — | CN | claimed |
| CN-107216281-A | A kind of cyano-containing Two-photon fluorescent dye and its preparation method and application | 山东省科学院新材料研究所 | 2017-09-29 | — | — | CN | claimed |
| CN-119481277-A | Lithium ion battery electrolyte and application thereof | 远景睿泰动力技术(上海)有限公司 | 2025-02-18 | — | — | CN | disclosed |
| CN-108863850-B | Biaryl compound and preparation method and application thereof | 复旦大学 | 2021-05-18 | — | — | CN | disclosed |
| CN-112186251-A | Non-aqueous electrolyte of lithium ion battery and lithium ion battery | 香河昆仑化学制品有限公司 | 2021-01-05 | — | — | CN | disclosed |
| CN-108863850-A | Biaryl base class compound and its preparation method and application | 复旦大学 | 2018-11-23 | — | — | CN | disclosed |
| CN-107216281-A | A kind of cyano-containing Two-photon fluorescent dye and its preparation method and application | 山东省科学院新材料研究所 | 2017-09-29 | — | — | CN | disclosed |
| CN-107216281-A | A kind of cyano-containing Two-photon fluorescent dye and its preparation method and application | 山东省科学院新材料研究所 | 2017-09-29 | — | — | CN | disclosed |