Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.32 |
| ▸ | ITGB3 | P05106 | 4/20 | 0.32 |
| ▸ | ITGA2B | P08514 | 4/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | GAA | P10253 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | MIF | P14174 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4184005 | 0.80 | NR1H2 (0.33) | — | |
| SCHEMBL5832615 | 0.80 | ALDH1A1 (0.47) | ALDH1A1CYP3A4CYP2C9CYP2C19KDM4E | |
| SCHEMBL785988 | 0.70 | HPGD (0.48) | ALDH1A1KDM4EGAAKMT2ATSHR | |
| SCHEMBL25281461 | 0.69 | HTR4 (0.39) | POLBPARP14ITGB3ITGA2BALDH1A1 | |
| SCHEMBL1717843 | 0.68 | POLB (0.38) | POLBPARP14ITGB3ITGA2BALDH1A1 | |
| SCHEMBL15874584 | 0.68 | NR1H2 (0.43) | ALDH1A1KDM4EGAAKMT2ATSHR | |
| SCHEMBL1899485 | 0.68 | NR1H2 (0.43) | ALDH1A1KDM4EGAAKMT2ATSHR | |
| SCHEMBL13624403 | 0.67 | POLB (0.40) | POLBPARP14ALDH1A1KMT2AMIF | |
| SCHEMBL27313851 | 0.67 | KMT2A (0.40) | POLBALDH1A1GAACYP1A2KMT2A | |
| SCHEMBL12788442 | 0.66 | KMT2A (0.37) | POLBPARP14ITGB3ITGA2BGAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1061076-B1 | N-ACYL CYCLIC AMINE DERIVATIVES | BANYU PHARMA CO LTD (JP) | 2004-12-08 | — | — | EP | disclosed |