Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.40 |
| ▸ | GAA | P10253 | 5/20 | 0.40 |
| ▸ | GLA | P06280 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.38 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.38 |
| ▸ | F2 | P00734 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | CASP7 | P55210 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | CFTR | P13569 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29042069 | 0.78 | TSHR (0.42) | TSHRKDM4EALDH1A1GAAGLA | |
| SCHEMBL29857790 | 0.78 | OPRK1 (0.49) | TSHRKDM4EALDH1A1GAAGLA | |
| SCHEMBL1093551 | 0.78 | OPRK1 (0.49) | TSHRKDM4EALDH1A1GAAGLA | |
| SCHEMBL27779499 | 0.77 | OPRK1 (0.48) | TSHRKDM4EALDH1A1GAAGLA | |
| SCHEMBL17382217 | 0.76 | ATM (0.47) | TSHRKDM4EALDH1A1GAAGLA | |
| SCHEMBL27818191 | 0.76 | KDM4E (0.50) | TSHRKDM4EALDH1A1GAAGLA | |
| SCHEMBL23079020 | 0.74 | OPRK1 (0.46) | TSHRKDM4EALDH1A1GAAGLA | |
| SCHEMBL29733564 | 0.74 | ABL1 (0.51) | TSHRKDM4EALDH1A1GAAGLA | |
| SCHEMBL2420694 | 0.74 | OPRK1 (0.46) | TSHRKDM4EALDH1A1GAAGLA | |
| SCHEMBL914850 | 0.74 | ABL1 (0.51) | TSHRKDM4EALDH1A1GAAGLA |
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-116478145-B | ALK2 kinase inhibitors | 杭州邦顺制药有限公司 | 2024-02-02 | — | — | CN | disclosed |
| CN-116478145-A | ALK2 kinase inhibitors | 杭州邦顺制药有限公司 | 2023-07-25 | — | — | CN | disclosed |