Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | LPL | P06858 | 1/20 | 0.35 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.35 |
| ▸ | PLK1 | P53350 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | METAP2 | P50579 | 1/20 | 0.32 |
| ▸ | PLAU | P00749 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL149323 | 0.84 | — | — | |
| SCHEMBL2491352 | 0.78 | TP53 (0.56) | SMN1; SMN2TP53TAAR1CYP2A6LPL | |
| SCHEMBL28189567 | 0.78 | LTA4H (0.57) | SMN1; SMN2TAAR1ALDH1A1CA2ATM | |
| SCHEMBL4537744 | 0.77 | CALM1 (0.57) | CAPN1TAAR1ALDH1A1TSHRLMNA | |
| Hydrochloric Acid SCHEMBL27693313 | 0.76 | CALM1 (0.55) | CAPN1TAAR1ALDH1A1CYP3A4LMNA | |
| SCHEMBL26783718 | 0.74 | CYP1A2 (0.55) | SMN1; SMN2TP53TAAR1CYP2A6LPL | |
| SCHEMBL24767288 | 0.71 | CAPN1 (0.35) | CAPN1 | |
| SCHEMBL152451 | 0.70 | — | — | |
| SCHEMBL36295 | 0.69 | TP53 (0.67) | SMN1; SMN2TP53TAAR1CYP2A6LPL | |
| SCHEMBL5031564 | 0.69 | TP53 (0.78) | SMN1; SMN2TP53TAAR1CYP2A6ALDH1A1 |
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-103214471-B | The preparation method of compound with Na-dependent glucose transporter inhibitory activity | 田边三菱制药株式会社 | 2018-02-06 | — | — | CN | disclosed |