Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.60 |
| ▸ | APP | P05067 | 12/20 | 0.57 |
| ▸ | MMP9 | P14780 | 1/20 | 0.57 |
| ▸ | MMP8 | P22894 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 5/20 | 0.51 |
| ▸ | GAA | P10253 | 5/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.51 |
| ▸ | GLA | P06280 | 4/20 | 0.51 |
| ▸ | NPC1 | O15118 | 3/20 | 0.51 |
| ▸ | RAB9A | P51151 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | TP53 | P04637 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.49 |
| ▸ | GFER | P55789 | 1/20 | 0.49 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.49 |
| ▸ | RELA | Q04206 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL10030530 | 0.89 | MAPT (0.63) | ALDH1A1APPMMP9MMP8MAPT | |
| SCHEMBL28033414 | 0.86 | ALDH1A1 (0.54) | ALDH1A1APPMMP9MMP8MAPT | |
| SCHEMBL900790 | 0.85 | ALDH1A1 (0.56) | ALDH1A1APPMAPTGAAKDM4E | |
| SCHEMBL28033974 | 0.84 | ALDH1A1 (0.51) | ALDH1A1APPMAPTGAAKDM4E | |
| SCHEMBL28033960 | 0.84 | ALDH1A1 (0.51) | ALDH1A1APPMAPTGAAKDM4E | |
| SCHEMBL4798607 | 0.84 | APP (0.58) | ALDH1A1APPMAPTGAAKDM4E | |
| SCHEMBL6403729 | 0.83 | APP (0.60) | ALDH1A1APPMMP9MMP8MAPT | |
| SCHEMBL23761942 | 0.83 | APP (0.50) | ALDH1A1APPMAPTGAAKDM4E | |
| SCHEMBL28174501 | 0.82 | APP (0.58) | ALDH1A1APPMMP9MMP8MAPT | |
| SCHEMBL3680730 | 0.81 | SMN1; SMN2 (0.60) | ALDH1A1APPMMP9MMP8MAPT |
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-114436971-A | Di (4- (benzoxazol-2-yl) phenyl) methylamine derivative and preparation method thereof | 陕西维世诺新材料有限公司 | 2022-05-06 | — | — | CN | disclosed |
| WO-2020043880-A1 | HETEROCYCLIC COMPOUNDS AS AHR MODULATORS | JAGUAHR THERAPEUTICS PTE LTD (SG) | 2020-03-05 | — | — | WO | disclosed |
| EP-0581245-B1 | Water-insoluble azo colouring agents | CLARIANT GMBH (DE) | 1998-12-23 | — | — | EP | disclosed |
| US-5428136-A | Water-insoluble azo colorants having two azo groups and a 1,4-bis (acetoacetylamino) benzene coupling component | HOECHST AG (DE) | 1995-06-27 | — | — | US | disclosed |
| EP-0581245-A1 | Water-insoluble azo colouring agents | HOECHST AKTIENGESELLSCHAFT (DE) | 1994-02-02 | — | — | EP | disclosed |