Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.30 |
| ▸ | RAB9A | P51151 | 2/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.30 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.30 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.30 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.30 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.30 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.30 |
| ▸ | GRIN3A | Q8TCU5 | 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 | |
|---|---|---|---|---|
| SCHEMBL4633923 | 0.80 | ALDH1A1 (0.56) | ALDH1A1TDP1TSHRMEN1KMT2A | |
| SCHEMBL29735720 | 0.78 | ALDH1A1 (0.54) | ALDH1A1TDP1TSHRMEN1KMT2A | |
| Ethoxycarbonyl Group SCHEMBL28078566 | 0.76 | CYP2C9 (0.34) | ALDH1A1CYP2C9CYP2C19MEN1KMT2A | |
| Ethoxycarbonyl Group SCHEMBL28254512 | 0.76 | HTT (0.39) | ALDH1A1TSHRCYP2C9CYP2C19MAPT | |
| Ethoxycarbonyl Group SCHEMBL28784270 | 0.75 | ERN1 (0.36) | ALDH1A1TDP1TSHRMEN1KMT2A | |
| Ethoxycarbonyl Group SCHEMBL27833104 | 0.74 | LMNA (0.48) | ALDH1A1MAPTRAB9AMEN1KMT2A | |
| SCHEMBL15871956 | 0.69 | MAPT (0.43) | ALDH1A1CYP2C9CYP2C19MAPTRAB9A | |
| SCHEMBL29301459 | 0.68 | ALDH1A1 (0.42) | ALDH1A1TDP1TSHRMAPTRAB9A | |
| SCHEMBL31481303 | 0.68 | ALDH1A1 (0.42) | ALDH1A1TDP1TSHRMEN1KMT2A | |
| SCHEMBL31553067 | 0.68 | ALDH1A1 (0.42) | ALDH1A1TDP1TSHRMAPTMEN1 |
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-105793236-A | Dimethylbenzoic acid compound | 伊莱利利公司 | 2016-07-20 | — | — | CN | disclosed |