Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH3A1 | P30838 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | MCOLN3 | Q8TDD5 | 2/20 | 0.43 |
| ▸ | CRHBP | P24387 | 1/20 | 0.43 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.43 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.42 |
| ▸ | CCR2 | P41597 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | ERN1 | O75460 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Hydrogen Peroxide SCHEMBL28682950 | 0.85 | TSHR (0.57) | ALDH3A1ALDH1A1MCOLN3CRHBPCRHR2 | |
| SCHEMBL994972 | 0.85 | MCOLN3 (0.58) | ALDH3A1ALDH1A1MCOLN3CRHBPCRHR2 | |
| SCHEMBL29397077 | 0.85 | MCOLN3 (0.58) | ALDH3A1ALDH1A1MCOLN3CRHBPCRHR2 | |
| SCHEMBL14008592 | 0.79 | VCAM1 (0.53) | ALDH3A1ALDH1A1ENPP2ERN1HTT | |
| SCHEMBL19068282 | 0.77 | ALDH1A1 (0.40) | ALDH3A1ALDH1A1ENPP2CCR2ERN1 | |
| SCHEMBL8367112 | 0.75 | TSHR (0.48) | ALDH1A1TSHR | |
| SCHEMBL758951 | 0.74 | LMNA (0.64) | ALDH1A1ENPP2HTTLMNATSHR | |
| SCHEMBL26936872 | 0.74 | ENPP2 (0.52) | ALDH1A1ENPP2LMNATSHR | |
| SCHEMBL6516381 | 0.73 | MAPT (0.53) | ALDH3A1ALDH1A1MCOLN3CRHBPCRHR2 | |
| SCHEMBL17347354 | 0.72 | ALDH1A1 (0.66) | ALDH1A1MAPK1LMNATSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-20150364311-A1 | COMPOSITIONS AND METHODS FOR MASS SPECTOMETRY | MSTM, LLC | 2015-12-17 | — | — | US | disclosed |