Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | ABL1 | P00519 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 3/20 | 0.35 |
| ▸ | CA1 | P00915 | 3/20 | 0.35 |
| ▸ | CA2 | P00918 | 3/20 | 0.35 |
| ▸ | CA7 | P43166 | 3/20 | 0.35 |
| ▸ | CA9 | Q16790 | 3/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL18053344 | 1.00 | LMNA (0.38) | LMNACYP1A2CYP3A4MAOATSHR | |
| SCHEMBL1831584 | 0.85 | TSHR (0.38) | LMNACYP1A2CYP3A4MAOATSHR | |
| SCHEMBL11796042 | 0.77 | TSHR (0.45) | LMNACYP1A2CYP3A4MAOATSHR | |
| SCHEMBL11525930 | 0.73 | ALDH1A1 (0.41) | LMNACYP3A4TSHRRAB9AALDH1A1 | |
| SCHEMBL14193666 | 0.71 | CA12 (0.42) | LMNACYP3A4TSHRRAB9AALDH1A1 | |
| SCHEMBL15820189 | 0.71 | CYP1A2 (0.35) | CYP1A2TSHRRAB9AALDH1A1HSD17B10 | |
| SCHEMBL15820195 | 0.70 | MEN1 (0.37) | TSHRRAB9AALDH1A1HSD17B10MAPT | |
| SCHEMBL8911607 | 0.70 | ALDH1A1 (0.36) | CYP1A2CYP3A4TSHRRAB9AALDH1A1 | |
| SCHEMBL11582658 | 0.70 | LMNA (0.46) | LMNACYP1A2CYP3A4MAOATSHR | |
| SCHEMBL11529682 | 0.69 | ALDH1A1 (0.47) | LMNACYP3A4TSHRRAB9AALDH1A1 |
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-110637022-B | Pyrrolopyrimidine derivatives as inhibitors of influenza virus replication | 共晶制药公司 | 2022-09-16 | — | — | CN | disclosed |