Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IMPDH2 | P12268 | 1/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | TSHR | P16473 | 3/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10709835 | 0.85 | IMPDH2 (0.46) | IMPDH2GABRA1GABRB2ALDH1A1TSHR | |
| SCHEMBL22369144 | 0.78 | TLR8 (0.38) | ALDH1A1TSHRCYP3A4HPGDTDP1 | |
| SCHEMBL1570705 | 0.78 | GABRA1 (0.47) | IMPDH2GABRA1GABRB2ALDH1A1TSHR | |
| SCHEMBL17097240 | 0.76 | EED (0.37) | GABRA1GABRB2ALDH1A1MEN1MAPT | |
| SCHEMBL472453 | 0.76 | GABRA1 (0.41) | GABRA1GABRB2ALDH1A1HSD17B10MEN1 | |
| SCHEMBL28694888 | 0.76 | GABRA1 (0.33) | GABRA1GABRB2ALDH1A1MEN1MAPT | |
| SCHEMBL7731174 | 0.76 | MAPT (0.35) | GABRA1GABRB2ALDH1A1MEN1MAPT | |
| SCHEMBL89099 | 0.76 | TSHR (0.43) | IMPDH2GABRA1GABRB2ALDH1A1TSHR | |
| SCHEMBL21987780 | 0.76 | IMPDH2 (0.40) | IMPDH2GABRA1GABRB2ALDH1A1TSHR | |
| Hydrochloric Acid SCHEMBL4050779 | 0.76 | GABRA1 (0.46) | IMPDH2GABRA1GABRB2ALDH1A1TSHR |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106243125-B | A kind of Molecular orbit compound and its synthetic method | 河南省科学院化学研究所有限公司 | 2018-12-21 | — | — | CN | claimed |
| CN-106243125-A | A kind of triphendioaxazine compound and synthetic method thereof | 河南省科学院化学研究所有限公司 | 2016-12-21 | — | — | CN | claimed |
| JP-7118442-A | — | — | None | — | — | JP | disclosed |
| CN-106243125-B | A kind of Molecular orbit compound and its synthetic method | 河南省科学院化学研究所有限公司 | 2018-12-21 | — | — | CN | disclosed |
| CN-106243125-A | A kind of triphendioaxazine compound and synthetic method thereof | 河南省科学院化学研究所有限公司 | 2016-12-21 | — | — | CN | disclosed |
| JP-H07118442-A | FLAME-RETARDANT MIXTURE | MANAC INC | 1995-05-09 | — | — | JP | disclosed |