Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 4/20 | 0.38 |
| ▸ | CES1 | P23141 | 4/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | DAO | P14920 | 1/20 | 0.38 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.38 |
| ▸ | G6PC1 | P35575 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | F2 | P00734 | 1/20 | 0.35 |
| ▸ | F10 | P00742 | 1/20 | 0.35 |
| ▸ | F12 | P00748 | 1/20 | 0.35 |
| ▸ | F7 | P08709 | 1/20 | 0.35 |
| ▸ | F3 | P13726 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL9914140 | 0.78 | CYP2C19 (0.44) | ATMCES2CES1TSHRALDH1A1 | |
| SCHEMBL11523631 | 0.74 | F2 (0.40) | ATMCES2CES1TSHRALDH1A1 | |
| SCHEMBL11523633 | 0.74 | F2 (0.40) | ATMCES2CES1TSHRALDH1A1 | |
| SCHEMBL862271 | 0.72 | ALDH1A1 (0.45) | ATMCES2CES1TSHRALDH1A1 | |
| SCHEMBL4547699 | 0.70 | LMNA (0.52) | ATMCES2CES1TSHRALDH1A1 | |
| SCHEMBL3443700 | 0.70 | LMNA (0.52) | ATMCES2CES1TSHRALDH1A1 | |
| SCHEMBL3443698 | 0.70 | LMNA (0.52) | ATMCES2CES1TSHRALDH1A1 | |
| SCHEMBL3067282 | 0.70 | GAA (0.54) | ATMCES2CES1TSHRALDH1A1 | |
| SCHEMBL3067286 | 0.70 | GAA (0.54) | ATMCES2CES1TSHRALDH1A1 | |
| SCHEMBL1568142 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020148303-A1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2020-07-23 | — | — | WO | disclosed |