Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | CHIA | Q9BZP6 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.37 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
| ▸ | PLAAT3 | P53816 | 1/20 | 0.36 |
| ▸ | PLAAT5 | Q96KN8 | 1/20 | 0.36 |
| ▸ | PLAAT2 | Q9NWW9 | 1/20 | 0.36 |
| ▸ | PLAAT4 | Q9UL19 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9639375 | 0.94 | PARP1 (0.46) | PARP1KMT2AMEN1TSHRHSD17B10 | |
| SCHEMBL9639398 | 0.88 | PARP1 (0.48) | PARP1KMT2AMEN1TSHRCHIA | |
| SCHEMBL9755187 | 0.87 | PARP1 (0.50) | PARP1KMT2AMEN1TSHRCHIA | |
| SCHEMBL9640899 | 0.84 | PARP1 (0.52) | PARP1KMT2AMEN1CHIAGAA | |
| Hydrochloric Acid SCHEMBL9755174 | 0.83 | PARP1 (0.51) | PARP1KMT2AMEN1CHIAGAA | |
| Acetic Acid SCHEMBL9639371 | 0.76 | HTR3E (0.53) | PARP1KMT2AMEN1ALDH1A1MAPK1 | |
| Propionic Acid SCHEMBL9640459 | 0.75 | HTR3E (0.52) | PARP1CHIAALDH1A1MAPK1 | |
| SCHEMBL9639544 | 0.74 | PARP1 (0.50) | PARP1CHIAALDH1A1 | |
| SCHEMBL9755222 | 0.73 | PARP1 (0.52) | PARP1KMT2AMEN1CHIAALDH1A1 | |
| SCHEMBL9639712 | 0.73 | PARP1 (0.46) | PARP1KMT2AMEN1TSHRCHIA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0496746-A1 | PHARMACEUTICALLY ACTIVE AMINO-SUBSTITUTED HETEROARYL AMINES | THE UPJOHN COMPANY (US) | 1992-08-05 | — | — | EP | claimed |
| WO-1991006542-A1 | PHARMACEUTICALLY ACTIVE AMINO-SUBSTITUTED HETEROARYL AMINES | THE UPJOHN COMPANY (US) | 1991-05-16 | — | — | WO | claimed |
| EP-0496746-A1 | PHARMACEUTICALLY ACTIVE AMINO-SUBSTITUTED HETEROARYL AMINES | THE UPJOHN COMPANY (US) | 1992-08-05 | — | — | EP | disclosed |
| WO-1991006542-A1 | PHARMACEUTICALLY ACTIVE AMINO-SUBSTITUTED HETEROARYL AMINES | THE UPJOHN COMPANY (US) | 1991-05-16 | — | — | WO | disclosed |