Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | TSHR | P16473 | 4/20 | 0.46 |
| ▸ | ACHE | P22303 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.35 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.33 |
| ▸ | TTR | P02766 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | THPO | P40225 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 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 | |
|---|---|---|---|---|
| SCHEMBL6469766 | 0.89 | ALDH1A1 (0.38) | ALDH1A1TSHRACHEKDM4ECYP1A2 | |
| SCHEMBL678151 | 0.89 | ALDH1A1 (0.56) | ALDH1A1TSHRACHEKDM4ERAB9A | |
| SCHEMBL14887 | 0.89 | — | — | |
| SCHEMBL29391686 | 0.89 | — | — | |
| SCHEMBL7921184 | 0.87 | ALDH1A1 (0.41) | ALDH1A1TSHRACHEKDM4ERAB9A | |
| SCHEMBL41438 | 0.86 | ALDH1A1 (0.39) | ALDH1A1TSHRACHEKDM4ECYP1A2 | |
| SCHEMBL30332485 | 0.86 | ALDH1A1 (0.39) | ALDH1A1TSHRACHEKDM4ECYP1A2 | |
| SCHEMBL16109755 | 0.86 | ALDH1A1 (0.54) | ALDH1A1TSHRACHEKDM4ERAB9A | |
| Benzene SCHEMBL11895034 | 0.86 | TSHR (0.54) | ALDH1A1TSHRACHEKDM4ERAB9A | |
| SCHEMBL7547692 | 0.86 | ALDH1A1 (0.54) | ALDH1A1TSHRACHEKDM4ERAB9A |
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-105899288-A | Method to provide pipeline quality natural gas | 陶氏环球技术有限责任公司 | 2016-08-24 | — | — | CN | disclosed |