Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 3/20 | 0.48 |
| ▸ | CA1 | P00915 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.46 |
| ▸ | AGXT | P21549 | 2/20 | 0.45 |
| ▸ | LTA4H | P09960 | 1/20 | 0.45 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | LDHA | P00338 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1453650 | 0.83 | IDO1 (0.52) | IDO1CA1CA2ENPP2CA12 | |
| SCHEMBL7032199 | 0.83 | IDO1 (0.52) | IDO1CA1CA2ENPP2CA12 | |
| SCHEMBL3898145 | 0.78 | IDO1 (0.56) | IDO1CA1CA2KDM4ECA12 | |
| SCHEMBL28046123 | 0.76 | IDO1 (0.45) | IDO1CA1CA2ENPP2CA12 | |
| SCHEMBL14604253 | 0.75 | LTA4H (0.55) | IDO1CA1CA2CA12CA7 | |
| 1,4-Dimethoxybenzene SCHEMBL27700725 | 0.74 | CA1 (0.85) | CA1CA2ENPP2KDM4ECA12 | |
| Methyl Alcohol SCHEMBL28311094 | 0.73 | IDO1 (0.56) | IDO1CA1CA2CA12CA7 | |
| Methyl Alcohol SCHEMBL28283803 | 0.71 | MAOB (0.68) | IDO1CA1CA2CA12CA7 | |
| Methyl Alcohol SCHEMBL28823289 | 0.71 | IDO1 (0.61) | IDO1CA1CA2CA12CA7 | |
| SCHEMBL28891213 | 0.71 | TAAR1 (0.55) | IDO1CA1CA2CALM1TAAR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108339571-A | P- chiral source organic phosphorus compounds | 国家科学研究中心 | 2018-07-31 | — | — | CN | disclosed |
| CN-103797020-B | P-chirality source organic phosphorus compound | 国家科学研究中心 | 2018-01-30 | — | — | CN | disclosed |