Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.44 |
| ▸ | FBP1 | P09467 | 3/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.42 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.42 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.41 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.41 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.41 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.41 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.41 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | CA5A | P35218 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL15668275 | 0.78 | MCL1 (0.49) | TSHRALDH1A1MCL1FBP1AKR1C3 | |
| SCHEMBL9246618 | 0.77 | NR1I2 (0.53) | TSHRALDH1A1FBP1AKR1C3NR1I2 | |
| SCHEMBL181652 | 0.73 | ALDH1A1 (0.56) | TSHRALDH1A1MCL1FBP1AKR1C3 | |
| SCHEMBL9001674 | 0.72 | AKR1C1 (0.48) | TSHRALDH1A1AKR1C3NR1I2AKR1C1 | |
| SCHEMBL8595072 | 0.72 | TSHR (0.41) | TSHRALDH1A1MCL1FBP1AKR1C3 | |
| SCHEMBL1579379 | 0.72 | AKR1C1 (0.48) | TSHRALDH1A1AKR1C3NR1I2AKR1C1 | |
| SCHEMBL2223295 | 0.72 | AKR1C3 (0.50) | TSHRALDH1A1MCL1AKR1C3NR1I2 | |
| SCHEMBL2223293 | 0.72 | AKR1C3 (0.50) | TSHRALDH1A1MCL1AKR1C3NR1I2 | |
| Phosphoric Acid SCHEMBL29150326 | 0.72 | TSHR (0.41) | TSHRALDH1A1MCL1FBP1AKR1C3 | |
| Phosphoric Acid SCHEMBL3676597 | 0.71 | AKR1C1 (0.61) | ALDH1A1MCL1AKR1C3AKR1C1CYP3A4 |
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-101421392-A | Use of indanoyl amide to stimulate secondary metabolism in taxus sp | PHYTON BIOTECH INC (US) | 2009-04-29 | — | — | CN | disclosed |