Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.37 |
| ▸ | ITGAV | P06756 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | APEX1 | P27695 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL19533069 | 0.86 | HTT (0.34) | ALDH1A1FKBP1AHTTBACE1BACE2 | |
| SCHEMBL12013341 | 0.86 | HTT (0.34) | ALDH1A1FKBP1AHTTBACE1BACE2 | |
| SCHEMBL20180680 | 0.86 | HTT (0.34) | ALDH1A1FKBP1AHTTBACE1BACE2 | |
| SCHEMBL20180516 | 0.86 | HTT (0.34) | ALDH1A1FKBP1AHTTBACE1BACE2 | |
| SCHEMBL20180664 | 0.86 | HTT (0.34) | ALDH1A1FKBP1AHTTBACE1BACE2 | |
| SCHEMBL23369279 | 0.86 | HTT (0.34) | ALDH1A1FKBP1AHTTBACE1BACE2 | |
| SCHEMBL19245754 | 0.85 | GPBAR1 (0.31) | ALDH1A1BACE1BACE2 | |
| SCHEMBL21126773 | 0.85 | GPBAR1 (0.31) | ALDH1A1BACE1BACE2 | |
| SCHEMBL17570992 | 0.85 | ALDH1A1 (0.33) | ALDH1A1BACE1BACE2 | |
| SCHEMBL24952144 | 0.85 | GPBAR1 (0.31) | ALDH1A1BACE1BACE2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2922575-B1 | TRIOXACARCINS, TRIOXACARCIN-ANTIBODY CONJUGATES, AND USES THEREOF | HARVARD COLLEGE (US) | 2019-06-26 | — | — | EP | disclosed |
| EP-3308801-A1 | ANTIBODY DRUG CONJUGATE, INTERMEDIATE, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USES THEREOF | XDCExplorer (Shanghai) Co., Ltd. (CN) | 2018-04-18 | — | — | EP | disclosed |