Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20839532 | 0.78 | CES2 (0.55) | KDM4EALOX15TSHRALDH1A1MAPT | |
| SCHEMBL28894651 | 0.77 | CA12 (0.33) | ALOX15TSHR | |
| SCHEMBL69653 | 0.73 | MAPT (0.64) | CYP1A2KDM4EALOX15TSHRACMSD | |
| SCHEMBL28464699 | 0.71 | TDP1 (0.43) | TSHRTDP1ALDH1A1KMT2APOLB | |
| SCHEMBL28665813 | 0.70 | CYP3A4 (0.47) | KDM4EALOX15TSHRTDP1ALDH1A1 | |
| SCHEMBL21331911 | 0.70 | KDM4E (0.74) | CYP1A2KDM4EALOX15TSHRACMSD | |
| SCHEMBL28389217 | 0.68 | LMNA (0.58) | TSHRTDP1ALDH1A1MAPTHSD17B10 | |
| SCHEMBL22946291 | 0.68 | TDP1 (0.61) | CYP1A2TSHRTDP1ALDH1A1MAPT | |
| SCHEMBL6217194 | 0.68 | CYP3A4 (0.59) | CYP1A2KDM4EALOX15TSHRACMSD | |
| SCHEMBL69458 | 0.68 | MAPT (0.75) | CYP1A2KDM4EALOX15TSHRACMSD |
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-111825711-B | Vanadium pyridine catalyst for preparing 2, 5-dichlorophenol by catalytic oxidation and synthesis method and application thereof | 四川福思达生物技术开发有限责任公司 | 2023-08-18 | — | — | CN | disclosed |