Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.42 |
| ▸ | BAD | Q92934 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 3/20 | 0.40 |
| ▸ | CA2 | P00918 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HCAR1 | Q9BXC0 | 2/20 | 0.39 |
| ▸ | HTR2C | P28335 | 4/20 | 0.38 |
| ▸ | HTR2A | P28223 | 3/20 | 0.38 |
| ▸ | KIF11 | P52732 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27368033 | 1.00 | ALDH1A1 (0.44) | ALDH1A1BCL2L1BADCA1CA2 | |
| SCHEMBL13300185 | 0.98 | ALDH1A1 (0.45) | ALDH1A1BCL2L1BADCA1CA2 | |
| SCHEMBL13300187 | 0.95 | ALDH1A1 (0.45) | ALDH1A1BCL2L1BADCA1CA2 | |
| SCHEMBL26536918 | 0.88 | ALDH1A1 (0.47) | ALDH1A1HCAR1HTR2CHTR2AKDM4E | |
| SCHEMBL20706821 | 0.80 | KDM4E (0.44) | ALDH1A1HCAR1KDM4EATML3MBTL1 | |
| SCHEMBL11910821 | 0.80 | ALDH1A1 (0.35) | ALDH1A1BCL2L1BADHCAR1KIF11 | |
| SCHEMBL13669350 | 0.80 | ALDH1A1 (0.35) | ALDH1A1BCL2L1BADHCAR1KIF11 | |
| SCHEMBL20706828 | 0.78 | KDM4E (0.41) | ALDH1A1HCAR1KDM4EATML3MBTL1 | |
| SCHEMBL13300183 | 0.75 | ALDH1A1 (0.41) | ALDH1A1HTR2CHTR2AKDM4EATM | |
| SCHEMBL15402268 | 0.73 | PNMT (0.44) | ALDH1A1CA1CA2HTR2CHTR2A |
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-20240215277-A1 | ORGANIC ELECTROLUMINESCENT DEVICE | MERCK PATENT GMBH (DE) | 2024-06-27 | — | — | US | disclosed |