Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.65 |
| ▸ | USP2 | O75604 | 2/20 | 0.65 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.65 |
| ▸ | LMNA | P02545 | 1/20 | 0.65 |
| ▸ | MMP9 | P14780 | 1/20 | 0.65 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.65 |
| ▸ | CA1 | P00915 | 16/20 | 0.36 |
| ▸ | CA2 | P00918 | 16/20 | 0.36 |
| ▸ | CA9 | Q16790 | 15/20 | 0.36 |
| ▸ | CA12 | O43570 | 5/20 | 0.34 |
| ▸ | CA7 | P43166 | 5/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 5/20 | 0.34 |
| ▸ | CA3 | P07451 | 4/20 | 0.34 |
| ▸ | CA4 | P22748 | 4/20 | 0.34 |
| ▸ | CA6 | P23280 | 4/20 | 0.34 |
| ▸ | CA5A | P35218 | 4/20 | 0.34 |
| ▸ | CA5B | Q9Y2D0 | 4/20 | 0.34 |
| ▸ | RECQL | P46063 | 2/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Treosulfan SCHEMBL5399430 | 0.89 | USP2 (0.43) | TSHRUSP2KDM4EALDH1A1LMNA | |
| Treosulfan SCHEMBL8466701 | 0.89 | USP2 (0.43) | TSHRUSP2KDM4EALDH1A1LMNA | |
| Treosulfan SCHEMBL8142 | 0.89 | USP2 (0.43) | TSHRUSP2KDM4EALDH1A1LMNA | |
| Busulfan SCHEMBL4373 | 0.81 | TSHR (1.00) | TSHRUSP2KDM4EALDH1A1LMNA | |
| Busulfan SCHEMBL4764696 | 0.81 | TSHR (1.00) | TSHRUSP2KDM4EALDH1A1LMNA | |
| SCHEMBL9359843 | 0.80 | LMNA (0.37) | TSHRUSP2KDM4EALDH1A1LMNA | |
| SCHEMBL9359906 | 0.80 | LMNA (0.37) | TSHRUSP2KDM4EALDH1A1LMNA | |
| SCHEMBL11980487 | 0.79 | TSHR (0.75) | TSHRUSP2KDM4EALDH1A1LMNA | |
| SCHEMBL4951404 | 0.79 | ALDH1A1 (0.40) | TSHRUSP2KDM4EALDH1A1LMNA | |
| Busulfan SCHEMBL27869023 | 0.79 | TSHR (0.75) | TSHRUSP2KDM4EALDH1A1LMNA |
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-103717597-B | Heterocyclic compounds as kinase inhibitors | 原真股份有限公司 | 2017-07-04 | — | — | CN | disclosed |
| CN-103492389-B | Pyrazolo [4,3-d] pyrimidine as inhibitors of kinases | 原真股份有限公司 | 2016-09-14 | — | — | CN | disclosed |