Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | APP | P05067 | 1/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.37 |
| ▸ | SRD5A1 | P18405 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.36 |
| ▸ | TTR | P02766 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Benzene SCHEMBL28318743 | 0.86 | BRD4 (0.40) | TSHRBRD4ALDH1A1KDM4EMEN1 | |
| SCHEMBL11934163 | 0.85 | TSHR (0.41) | TSHRBRD4ALDH1A1KDM4EMEN1 | |
| Benzene SCHEMBL28213036 | 0.84 | BRD4 (0.39) | TSHRBRD4ALDH1A1KDM4EMEN1 | |
| Naphthalene SCHEMBL28253258 | 0.82 | CYP2C19 (0.42) | TSHRBRD4ALDH1A1KDM4EMEN1 | |
| SCHEMBL11934162 | 0.80 | MAOA (0.43) | ALDH1A1KDM4EMEN1KMT2ACYP2C19 | |
| SCHEMBL28334942 | 0.78 | MAOA (0.41) | ALDH1A1KDM4EMEN1KMT2ACYP2C19 | |
| Ammonia Solution, Strong SCHEMBL28279025 | 0.78 | MAOA (0.41) | ALDH1A1KDM4EMEN1KMT2ACYP2C19 | |
| SCHEMBL27742309 | 0.78 | MAOA (0.41) | ALDH1A1KDM4EMEN1KMT2ACYP2C19 | |
| SCHEMBL27621718 | 0.78 | MAOA (0.41) | ALDH1A1KDM4EMEN1KMT2ACYP2C19 | |
| Zinc Ion SCHEMBL27762063 | 0.76 | MAOA (0.40) | ALDH1A1KDM4EMEN1KMT2ACYP2C19 |
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-108440386-A | A kind of preparation method of two-photon fluorescence pH probes and its application in cell imaging | 遵义师范学院 | 2018-08-24 | — | — | CN | disclosed |