Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | PRKDC | P78527 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | ESPL1 | Q14674 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.43 |
| ▸ | TUBB | P07437 | 1/20 | 0.43 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.43 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.43 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.43 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.43 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL12458650 | 1.00 | ALDH1A1 (0.48) | ALDH1A1TDP1KDM4ECYP3A4MAPT | |
| SCHEMBL1766175 | 0.90 | ALDH1A1 (0.58) | ALDH1A1TDP1KDM4ECYP3A4MAPT | |
| SCHEMBL31377991 | 0.90 | ALDH1A1 (0.58) | ALDH1A1TDP1KDM4ECYP3A4MAPT | |
| SCHEMBL29661436 | 0.90 | ALDH1A1 (0.50) | ALDH1A1TDP1KDM4ECYP3A4MAPT | |
| SCHEMBL517768 | 0.90 | ALDH1A1 (0.50) | ALDH1A1TDP1KDM4ECYP3A4MAPT | |
| SCHEMBL31757016 | 0.89 | ALDH1A1 (0.51) | ALDH1A1TDP1KDM4ECYP3A4MAPT | |
| SCHEMBL30230904 | 0.89 | ALDH1A1 (0.48) | ALDH1A1TDP1KDM4ECYP3A4MAPT | |
| SCHEMBL4279356 | 0.89 | ALDH1A1 (0.48) | ALDH1A1TDP1KDM4ECYP3A4MAPT | |
| SCHEMBL6370055 | 0.86 | ALDH1A1 (0.57) | ALDH1A1TDP1KDM4ECYP3A4MAPT | |
| SCHEMBL15744027 | 0.85 | ALDH1A1 (0.46) | ALDH1A1TDP1KDM4ECYP3A4MAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112341346-B | Synthesis method of Orientinib intermediate | 烟台舜康生物科技有限公司 | 2024-03-08 | — | — | CN | claimed |
| CN-112341346-B | Synthesis method of Orientinib intermediate | 烟台舜康生物科技有限公司 | 2024-03-08 | — | — | CN | disclosed |
| CN-112341346-B | Synthesis method of Orientinib intermediate | 烟台舜康生物科技有限公司 | 2024-03-08 | — | — | CN | disclosed |