Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 9/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 7/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL31409223 | 0.98 | CYP3A4 (0.44) | IDO1CYP3A4MAPTCYP1A2PKM | |
| SCHEMBL17113747 | 0.77 | CYP3A4 (0.42) | CYP3A4MAPTCYP1A2HDAC3HDAC1 | |
| SCHEMBL31438174 | 0.75 | RAPGEF4 (0.40) | IDO1MAPTKDM4ELMNAALDH1A1 | |
| SCHEMBL8178160 | 0.75 | MAPT (0.46) | IDO1CYP3A4MAPTMAPK1KMT2A | |
| SCHEMBL6784532 | 0.73 | ALDH1A1 (0.53) | IDO1CYP3A4MAPTMAPK1KMT2A | |
| SCHEMBL28422762 | 0.73 | SLC6A2 (0.39) | CYP3A4MAPTCYP1A2MAPK1HDAC3 | |
| SCHEMBL8217518 | 0.72 | TAAR1 (0.52) | IDO1CYP3A4MAPTCYP1A2PKM | |
| Methylamine SCHEMBL27702805 | 0.72 | TRPA1 (0.55) | CYP3A4MAPTCYP1A2CYP2C9KMT2A | |
| SCHEMBL16108407 | 0.72 | MAPT (0.44) | CYP3A4MAPTCYP1A2HDAC3HDAC1 | |
| SCHEMBL11630639 | 0.72 | NOS2 (0.37) | IDO1CYP3A4MAPTCYP1A2NFKB1 |
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-113121382-B | Metal compound material and preparation method thereof, quantum dot light emitting diode and light emitting device | TCL科技集团股份有限公司 | 2023-08-25 | — | — | CN | disclosed |