Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.38 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | C3AR1 | Q16581 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| P-Xylene SCHEMBL28217852 | 0.93 | IDO1 (0.38) | CYP3A4ALDH1A1AGTR1MEN1KMT2A | |
| SCHEMBL9073026 | 0.81 | CYP3A4 (0.46) | CYP3A4ALDH1A1AGTR1RAPGEF4MAPT | |
| SCHEMBL89325 | 0.78 | — | — | |
| SCHEMBL1313272 | 0.76 | CYP3A4 (0.54) | CYP3A4ALDH1A1AGTR1RAPGEF4MAPT | |
| Water SCHEMBL28511306 | 0.76 | CYP3A4 (0.54) | CYP3A4ALDH1A1AGTR1RAPGEF4MAPT | |
| P-Xylene SCHEMBL28885093 | 0.76 | IDO1 (0.52) | ALDH1A1MAPTIDO1CYP1A2TP53 | |
| SCHEMBL174063 | 0.76 | — | — | |
| SCHEMBL28760338 | 0.75 | IDO1 (0.39) | CYP3A4ALDH1A1AGTR1MEN1KMT2A | |
| P-Xylene SCHEMBL28217850 | 0.73 | NFE2L2 (0.42) | CYP3A4ALDH1A1AGTR1RAPGEF4MEN1 | |
| SCHEMBL18553016 | 0.73 | TAAR1 (0.45) | CYP3A4ALDH1A1AGTR1RAPGEF4NPSR1 |
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-108101027-A | Large area CVD graphenes adulterate transfer method | 重庆墨希科技有限公司 | 2018-06-01 | — | — | CN | disclosed |