Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 3/20 | 0.38 |
| ▸ | RECQL | P46063 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | NSD2 | O96028 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | APEX1 | P27695 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28006638 | 0.90 | MEN1 (0.40) | ALDH1A1L3MBTL1LMNAPOLBTDP1 | |
| SCHEMBL28006964 | 0.90 | TRPA1 (0.44) | ALDH1A1KDM4EL3MBTL1LMNAPOLB | |
| SCHEMBL28006996 | 0.84 | RARB (0.39) | ALDH1A1KDM4EL3MBTL1CSNK1E | |
| SCHEMBL28006630 | 0.82 | POLB (0.44) | ALDH1A1KDM4EL3MBTL1LMNAPOLB | |
| SCHEMBL28007034 | 0.82 | TPMT (0.47) | KDM4EL3MBTL1POLBRECQLTDP1 | |
| SCHEMBL28006623 | 0.81 | ALDH1A1 (0.38) | ALDH1A1KDM4EL3MBTL1LMNAPOLB | |
| SCHEMBL28006955 | 0.80 | MEN1 (0.42) | ALDH1A1L3MBTL1LMNAPOLBTDP1 | |
| Butane SCHEMBL27422579 | 0.78 | TSHR (0.47) | ALDH1A1KDM4EL3MBTL1POLBRECQL | |
| SCHEMBL3654793 | 0.78 | TRPA1 (0.55) | POLBCSNK1EHDAC3HDAC4HDAC1 | |
| Benzene SCHEMBL27546363 | 0.76 | KDM4E (0.55) | ALDH1A1KDM4ETDP1ESR1HPGD |
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-104428421-A | Process for using tobacco | KIND CONSUMER LTD | 2015-03-18 | — | — | CN | disclosed |