Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSPA5 | P11021 | 1/20 | 0.38 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.38 |
| ▸ | MGLL | Q99685 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GSR | P00390 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.33 |
| ▸ | ITGB7 | P26010 | 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 | |
|---|---|---|---|---|
| SCHEMBL726420 | 0.87 | HSPA5 (0.38) | HSPA5AKR1B1MGLLTSHRCYP2D6 | |
| SCHEMBL11239755 | 0.81 | MGLL (0.41) | HSPA5AKR1B1MGLLTSHRCYP2D6 | |
| SCHEMBL28899674 | 0.81 | MGLL (0.41) | HSPA5AKR1B1MGLLTSHRCYP2D6 | |
| SCHEMBL10455741 | 0.78 | HSPA5 (0.45) | HSPA5AKR1B1MGLLTSHRCYP2D6 | |
| SCHEMBL27686233 | 0.77 | TSHR (0.40) | AKR1B1MGLLTSHR | |
| SCHEMBL28051901 | 0.73 | TAAR1 (0.43) | TSHRCA2TAAR1SLC6A2 | |
| SCHEMBL29116349 | 0.72 | HSPA5 (0.46) | HSPA5AKR1B1TSHRCYP2D6HIF1A | |
| SCHEMBL28472388 | 0.71 | ITGA4 (0.40) | HSPA5AKR1B1TSHRCYP2D6HIF1A | |
| SCHEMBL10958798 | 0.70 | HSPA5 (0.45) | HSPA5AKR1B1TSHRCYP2D6HIF1A | |
| SCHEMBL29729482 | 0.69 | MGLL (0.44) | HSPA5AKR1B1MGLLTSHRCYP2D6 |
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-105330984-A | TPV composition and automobile hand brake grip coating material | ANHUI XIONGYA PLASTIC TECHNOLOGY CO LTD | 2016-02-17 | — | — | CN | disclosed |