Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | KIF11 | P52732 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | TRPV6 | Q9H1D0 | 2/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | KCNN4 | O15554 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | CA4 | P22748 | 1/20 | 0.32 |
| ▸ | CA6 | P23280 | 1/20 | 0.32 |
| ▸ | CA5A | P35218 | 1/20 | 0.32 |
| ▸ | CA7 | P43166 | 1/20 | 0.32 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.32 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.32 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.32 |
| ▸ | PCSK9 | Q8NBP7 | 1/20 | 0.32 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.32 |
| ▸ | ORAI2 | Q96SN7 | 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 | |
|---|---|---|---|---|
| SCHEMBL723306 | 1.00 | ALDH1A1 (0.37) | ALDH1A1TSHRKIF11ALOX15TRPV6 | |
| SCHEMBL1333551 | 0.98 | ALDH1A1 (0.39) | ALDH1A1TSHRKIF11ALOX15TRPV6 | |
| Ammonia Solution, Strong SCHEMBL9347147 | 0.96 | ALDH1A1 (0.37) | ALDH1A1TSHRKIF11ALOX15TRPV6 | |
| Pyridine SCHEMBL6516960 | 0.89 | TSHR (0.34) | ALDH1A1TSHRKIF11TRPV6CYP2C19 | |
| SCHEMBL8182003 | 0.86 | KIF11 (0.42) | KIF11CA4ENPP2KCNH2 | |
| Benzene SCHEMBL27568485 | 0.79 | KIF11 (0.40) | ALDH1A1TSHRKIF11ALOX15TRPV6 | |
| SCHEMBL723986 | 0.79 | KIF11 (0.40) | ALDH1A1TSHRKIF11ALOX15TRPV6 | |
| SCHEMBL28419769 | 0.79 | KIF11 (0.40) | ALDH1A1TSHRKIF11ALOX15TRPV6 | |
| SCHEMBL1333548 | 0.79 | TSHR (0.42) | ALDH1A1TSHRKIF11ALOX15TRPV6 | |
| SCHEMBL17684847 | 0.77 | NR3C2 (0.36) | ALDH1A1KIF11ENPP2ORAI1ORAI2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-111825524-A | Preparation method and application of cyclic diol containing bridged ring structure | 广东新华粤石化集团股份公司 | 2020-10-27 | — | — | CN | disclosed |
| US-5541284-A | TREATING WITH WATER VAPOR | DEQUSSA AKTIENGESELLSCHAFT (DE) | 1996-07-30 | — | — | US | disclosed |