Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNKS | O95271 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | HTR3A | P46098 | 2/20 | 0.34 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
| ▸ | NPFFR1 | Q9GZQ6 | 1/20 | 0.33 |
| ▸ | NPFFR2 | Q9Y5X5 | 1/20 | 0.33 |
| ▸ | CASR | P41180 | 2/20 | 0.33 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18554706 | 1.00 | TNKS (0.36) | TNKSPARP1TNKS2CYP11B2CYP11B1 | |
| SCHEMBL26167592 | 0.85 | HTR3A (0.43) | TNKSPARP1TNKS2CYP11B2CYP11B1 | |
| SCHEMBL20580625 | 0.77 | HTR3A (0.40) | TNKSPARP1TNKS2KMT2AALDH1A1 | |
| SCHEMBL22330373 | 0.70 | HTR3A (0.45) | KMT2AALDH1A1MEN1KDM4EUSP2 | |
| SCHEMBL18583115 | 0.70 | TNKS (0.44) | TNKSPARP1TNKS2KMT2AALDH1A1 | |
| SCHEMBL18463931 | 0.68 | HTR3A (0.43) | KMT2AALDH1A1MEN1KDM4EUSP2 | |
| Reproxalap SCHEMBL29536691 | 0.68 | TNKS (0.39) | TNKSPARP1TNKS2CYP11B2CYP11B1 | |
| Reproxalap SCHEMBL29354850 | 0.68 | TNKS (0.39) | TNKSPARP1TNKS2CYP11B2CYP11B1 | |
| Reproxalap SCHEMBL12228833 | 0.68 | TNKS (0.39) | TNKSPARP1TNKS2CYP11B2CYP11B1 | |
| SCHEMBL8005264 | 0.66 | CYP1A2 (0.55) | CYP11B2CYP11B1KMT2AALDH1A1MEN1 |
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-118724806-A | Deuterated compounds and their use | 奥尔德拉医疗公司 | 2024-10-01 | — | — | CN | disclosed |