Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | AR | P10275 | 3/20 | 0.38 |
| ▸ | HPGDS | O60760 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | S100B | P04271 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14871817 | 0.81 | AR (0.40) | ALDH1A1KDM4EUSP2ARHPGDS | |
| SCHEMBL16122060 | 0.81 | ALDH1A1 (0.43) | ALDH1A1KDM4EUSP2ARHPGDS | |
| SCHEMBL1116020 | 0.81 | ALDH1A1 (0.43) | ALDH1A1KDM4EUSP2CYP3A4L3MBTL1 | |
| SCHEMBL16072320 | 0.79 | AR (0.45) | ALDH1A1KDM4EUSP2ARHPGDS | |
| SCHEMBL1496436 | 0.79 | AR (0.42) | ALDH1A1KDM4EUSP2CYP3A4L3MBTL1 | |
| SCHEMBL17522205 | 0.79 | POLB (0.38) | ALDH1A1KDM4EUSP2POLBAR | |
| SCHEMBL7927109 | 0.78 | ALDH1A1 (0.47) | ALDH1A1KDM4EUSP2CYP3A4L3MBTL1 | |
| SCHEMBL17744575 | 0.78 | TTR (0.44) | ALDH1A1KDM4EUSP2CYP3A4L3MBTL1 | |
| SCHEMBL29104000 | 0.78 | ALDH1A1 (0.41) | ALDH1A1KDM4EUSP2CYP3A4L3MBTL1 | |
| SCHEMBL18112970 | 0.78 | MEN1 (0.44) | ALDH1A1KDM4EUSP2L3MBTL1POLB |
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-3943087-A1 | HETEROARYL COMPOUNDS AND USES THEREOF | Celgene CAR LLC (BM) | 2022-01-26 | — | — | EP | disclosed |
| EP-2968337-B1 | HETEROARYL COMPOUNDS AND USES THEREOF | CELGENE CAR LLC (BM) | 2021-07-21 | — | — | EP | disclosed |