Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 3/20 | 0.33 |
| ▸ | RAB9A | P51151 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.33 |
| ▸ | RELA | Q04206 | 2/20 | 0.33 |
| ▸ | GFER | P55789 | 2/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | IDO1 | P14902 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL23884 | 1.00 | ALDH1A1 (0.36) | ALDH1A1KDM4EL3MBTL1KMT2AMAPK1 | |
| SCHEMBL24859 | 0.85 | ALDH1A1 (0.33) | ALDH1A1KDM4EL3MBTL1KMT2ANPC1 | |
| SCHEMBL24860 | 0.85 | ALDH1A1 (0.33) | ALDH1A1KDM4EL3MBTL1KMT2ANPC1 | |
| SCHEMBL25622 | 0.81 | ALDH1A1 (0.32) | ALDH1A1KDM4EL3MBTL1KMT2AMEN1 | |
| SCHEMBL25621 | 0.81 | ALDH1A1 (0.32) | ALDH1A1KDM4EL3MBTL1KMT2AMEN1 | |
| SCHEMBL24616 | 0.80 | ALDH1A1 (0.40) | ALDH1A1KMT2AMEN1AKR1C3MAPT | |
| SCHEMBL24398 | 0.72 | IDO1 (0.31) | L3MBTL1IDO1 | |
| SCHEMBL22547324 | 0.71 | SRD5A1 (0.46) | IDO1 | |
| SCHEMBL25694 | 0.71 | SLC6A4 (0.47) | IDO1 | |
| SCHEMBL17052361 | 0.70 | IDO1 (0.33) | ALDH1A1KDM4EIDO1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012026403-A1 | CONDENSED RING COMPOUND | 日本曹達株式会社 (JP) | 2012-03-01 | — | — | WO | disclosed |
| WO-2012026403-A1 | CONDENSED RING COMPOUND | 日本曹達株式会社 (JP) | 2012-03-01 | — | — | WO | disclosed |