Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.58 |
| ▸ | CA2 | P00918 | 1/20 | 0.58 |
| ▸ | MMP1 | P03956 | 1/20 | 0.58 |
| ▸ | MMP2 | P08253 | 1/20 | 0.58 |
| ▸ | MMP9 | P14780 | 1/20 | 0.58 |
| ▸ | MMP8 | P22894 | 1/20 | 0.58 |
| ▸ | MMP13 | P45452 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | CA12 | O43570 | 5/20 | 0.51 |
| ▸ | CA9 | Q16790 | 5/20 | 0.51 |
| ▸ | F2 | P00734 | 1/20 | 0.50 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.50 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.50 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.50 |
| ▸ | CCR8 | P51685 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL27768339 | 0.82 | ALDH1A1 (0.57) | ALDH1A1MAPTL3MBTL1LMNAMEN1 | |
| SCHEMBL17479351 | 0.81 | KMT2A (0.56) | ALDH1A1MAPTL3MBTL1LMNAMEN1 | |
| SCHEMBL14484919 | 0.80 | LMNA (0.68) | ALDH1A1MAPTL3MBTL1LMNAMEN1 | |
| SCHEMBL3526582 | 0.79 | ALDH1A1 (0.50) | CA1CA2MMP1MMP2MMP9 | |
| SCHEMBL8397052 | 0.76 | CA1 (0.75) | CA1CA2MMP1MMP2MMP9 | |
| SCHEMBL13280385 | 0.76 | ALDH1A1 (0.43) | CA1CA2MMP1MMP2MMP9 | |
| SCHEMBL4599595 | 0.76 | TSHR (0.51) | CA1CA2MMP1MMP2MMP9 | |
| SCHEMBL15333501 | 0.76 | ALDH1A1 (0.61) | CA1CA2ALDH1A1MAPTL3MBTL1 | |
| SCHEMBL14856067 | 0.76 | ALDH1A1 (0.57) | CA1CA2MMP1MMP2MMP9 | |
| SCHEMBL26999803 | 0.76 | CA1 (0.48) | CA1CA2MMP1MMP2MMP9 |
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-114008024-A | Compounds having iron death inducing activity and methods of using the same | 费罗治疗公司 | 2022-02-01 | — | — | CN | disclosed |