Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.71 |
| ▸ | TSHR | P16473 | 4/20 | 0.71 |
| ▸ | LMNA | P02545 | 1/20 | 0.71 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.68 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.68 |
| ▸ | TP53 | P04637 | 1/20 | 0.68 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.61 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.61 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.59 |
| ▸ | POLB | P06746 | 1/20 | 0.59 |
| ▸ | CNR2 | P34972 | 1/20 | 0.54 |
| ▸ | ESR1 | P03372 | 1/20 | 0.51 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.51 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.51 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.51 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL1790206 | 0.92 | ALDH1A1 (0.79) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL818473 | 0.92 | ALDH1A1 (0.79) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL820186 | 0.92 | ALDH1A1 (0.79) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL10482944 | 0.92 | ALDH1A1 (0.79) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL570966 | 0.91 | ALDH1A1 (0.77) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| Benzophenone SCHEMBL27409790 | 0.90 | ALDH1A1 (0.82) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL18473273 | 0.90 | TSHR (0.79) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL27676643 | 0.88 | ALDH1A1 (0.65) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| Benzoic Acid SCHEMBL8840787 | 0.88 | TSHR (0.68) | ALDH1A1TSHRLMNACYP3A4MAPK1 | |
| SCHEMBL8927962 | 0.87 | ALDH1A1 (0.81) | ALDH1A1TSHRLMNACYP3A4MAPK1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105246906-B | Process for preparing metal organic compounds | 英国贝尔法斯特女王大学 | 2018-07-31 | — | — | CN | disclosed |