Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | PARP1 | P09874 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.50 |
| ▸ | BLM | P54132 | 1/20 | 0.50 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | CES2 | O00748 | 2/20 | 0.42 |
| ▸ | CES1 | P23141 | 2/20 | 0.42 |
| ▸ | DAO | P14920 | 1/20 | 0.42 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.42 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4125957 | 0.82 | TDP1 (0.54) | CYP2C19TSHRTDP1L3MBTL1POLB | |
| SCHEMBL1574223 | 0.81 | CES1 (0.55) | CYP2C19TSHRTDP1L3MBTL1POLB | |
| SCHEMBL6933107 | 0.78 | BLM (0.50) | CYP2C19TSHRTDP1L3MBTL1POLB | |
| SCHEMBL6267389 | 0.78 | TSHR (0.50) | CYP2C19TSHRTDP1L3MBTL1POLB | |
| SCHEMBL6280366 | 0.77 | CES1 (0.50) | CYP2C19TSHRTDP1L3MBTL1POLB | |
| Ethylene SCHEMBL28318847 | 0.75 | TSHR (0.46) | CYP2C19TSHRTDP1L3MBTL1POLB | |
| SCHEMBL27645357 | 0.75 | TDP1 (0.46) | CYP2C19TSHRTDP1L3MBTL1POLB | |
| SCHEMBL11589556 | 0.75 | TDP1 (0.46) | CYP2C19TSHRTDP1L3MBTL1POLB | |
| SCHEMBL23069336 | 0.75 | CA2 (0.56) | CYP2C19TSHRTDP1L3MBTL1POLB | |
| Thiourea SCHEMBL15399733 | 0.74 | MAPT (0.45) | CYP2C19TSHRTDP1L3MBTL1POLB |
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-114441572-A | Method for continuous rotation precession electron diffraction tomography | 苏州青云瑞晶生物科技有限公司 | 2022-05-06 | — | — | CN | disclosed |