Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | LMNA | P02545 | 4/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | CA12 | O43570 | 2/20 | 0.47 |
| ▸ | CA9 | Q16790 | 2/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.41 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
| ▸ | CA6 | P23280 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL18296891 | 0.83 | ALDH1A1 (0.48) | ALDH1A1LMNASMN1; SMN2HCAR2TDP1 | |
| SCHEMBL3389946 | 0.82 | ALDH1A1 (0.52) | ALDH1A1LMNASMN1; SMN2HCAR2TDP1 | |
| SCHEMBL23788401 | 0.79 | ALDH1A1 (0.53) | ALDH1A1LMNASMN1; SMN2HCAR2TDP1 | |
| SCHEMBL20442538 | 0.79 | LMNA (0.49) | ALDH1A1LMNASMN1; SMN2HCAR2TDP1 | |
| SCHEMBL19057196 | 0.78 | ALDH1A1 (0.56) | ALDH1A1LMNASMN1; SMN2HCAR2TDP1 | |
| SCHEMBL4246837 | 0.78 | ALDH1A1 (0.56) | ALDH1A1LMNASMN1; SMN2HCAR2TDP1 | |
| SCHEMBL812094 | 0.78 | HCAR2 (0.65) | ALDH1A1LMNASMN1; SMN2HCAR2TDP1 | |
| SCHEMBL19650334 | 0.77 | ALDH1A1 (0.52) | ALDH1A1LMNASMN1; SMN2HCAR2TDP1 | |
| SCHEMBL19977986 | 0.77 | LMNA (0.47) | ALDH1A1LMNASMN1; SMN2HCAR2TDP1 | |
| SCHEMBL19651893 | 0.76 | ALDH1A1 (0.50) | ALDH1A1LMNASMN1; SMN2HCAR2TDP1 |
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-116745292-A | Substituted pyridotriazine compounds and uses thereof | 吉利德科学公司 | 2023-09-12 | — | — | CN | disclosed |