Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.50 |
| ▸ | HPGD | P15428 | 6/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.50 |
| ▸ | MAPT | P10636 | 5/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | TNF | P01375 | 1/20 | 0.50 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.46 |
| ▸ | RELA | Q04206 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Benzene SCHEMBL28202246 | 0.85 | ALDH1A1 (0.56) | ALDH1A1HPGDKDM4EMAPTSMN1; SMN2 | |
| Phenanthrene SCHEMBL27542935 | 0.83 | ALDH1A1 (0.63) | ALDH1A1HPGDKDM4EMAPTSMN1; SMN2 | |
| SCHEMBL25302086 | 0.83 | ALDH1A1 (0.59) | ALDH1A1HPGDKDM4EMAPTSMN1; SMN2 | |
| SCHEMBL27953 | 0.83 | ALDH1A1 (0.59) | ALDH1A1HPGDKDM4EMAPTSMN1; SMN2 | |
| SCHEMBL29350007 | 0.83 | ALDH1A1 (0.59) | ALDH1A1HPGDKDM4EMAPTSMN1; SMN2 | |
| SCHEMBL13203236 | 0.80 | TNF (0.63) | ALDH1A1HPGDKDM4EMAPTSMN1; SMN2 | |
| SCHEMBL30756642 | 0.80 | TNF (0.63) | ALDH1A1HPGDKDM4EMAPTSMN1; SMN2 | |
| Bromide SCHEMBL8588309 | 0.80 | ALDH1A1 (0.56) | ALDH1A1HPGDKDM4EMAPTSMN1; SMN2 | |
| SCHEMBL18174178 | 0.80 | ALDH1A1 (0.56) | ALDH1A1HPGDKDM4EMAPTSMN1; SMN2 | |
| Ammonia Solution, Strong SCHEMBL3156160 | 0.80 | ALDH1A1 (0.56) | ALDH1A1HPGDKDM4EMAPTSMN1; SMN2 |
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-111675649-B | Dinaphthalene pyridinium antibacterial material and preparation method and application thereof | 山西大学 | 2021-09-28 | — | — | CN | claimed |
| CN-111675649-A | Dinaphthalene pyridinium antibacterial material and preparation method and application thereof | 山西大学 | 2020-09-18 | — | — | CN | claimed |
| CN-104829771-B | A kind of side chain contains polymer of ring-type azobenzene binaphthyl structure and its production and use | 苏州大学 | 2017-08-01 | — | — | CN | claimed |
| CN-111675649-B | Dinaphthalene pyridinium antibacterial material and preparation method and application thereof | 山西大学 | 2021-09-28 | — | — | CN | disclosed |
| CN-111675649-A | Dinaphthalene pyridinium antibacterial material and preparation method and application thereof | 山西大学 | 2020-09-18 | — | — | CN | disclosed |