Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.35 |
| ▸ | POLB | P06746 | 3/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | APEX1 | P27695 | 1/20 | 0.35 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 4/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.34 |
| ▸ | RECQL | P46063 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8705201 | 0.80 | CYP1A2 (0.36) | CYP1A2NPSR1ALDH1A1LMNAL3MBTL1 | |
| SCHEMBL8700223 | 0.79 | MAPT (0.42) | CYP1A2NPSR1ALDH1A1LMNAL3MBTL1 | |
| Hydrochloric Acid SCHEMBL8699955 | 0.78 | MAPT (0.41) | CYP1A2NPSR1ALDH1A1LMNAL3MBTL1 | |
| Hydrochloric Acid SCHEMBL8700510 | 0.78 | MAPT (0.41) | CYP1A2NPSR1ALDH1A1LMNAL3MBTL1 | |
| SCHEMBL8706111 | 0.70 | ALDH1A1 (0.39) | CYP1A2ALDH1A1L3MBTL1POLBTDP1 | |
| SCHEMBL8703747 | 0.69 | CYP1A2 (0.45) | CYP1A2NPSR1ALDH1A1LMNAL3MBTL1 | |
| SCHEMBL10592440 | 0.68 | KMT2A (0.52) | CYP1A2ALDH1A1LMNAL3MBTL1POLB | |
| Hydrochloric Acid SCHEMBL8704303 | 0.68 | CYP1A2 (0.44) | CYP1A2NPSR1ALDH1A1LMNAL3MBTL1 | |
| SCHEMBL10366987 | 0.67 | ALDH1A1 (0.51) | CYP1A2ALDH1A1LMNAMAPTCYP2C19 | |
| SCHEMBL15320289 | 0.67 | CYP2C19 (0.50) | CYP1A2NPSR1ALDH1A1LMNAL3MBTL1 |
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-5824691-A | CARDIOVASCULAR, CEREBROVASCULAR, RENAL DISEASES; SHOCK, ARTERIOSCLEROSIS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1998-10-20 | — | — | US | disclosed |