Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.40 |
| ▸ | SCD | O00767 | 1/20 | 0.40 |
| ▸ | SCD5 | Q86SK9 | 1/20 | 0.40 |
| ▸ | RET | P07949 | 2/20 | 0.38 |
| ▸ | MMP13 | P45452 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL27695831 | 0.75 | ALDH1A1 (0.43) | ALDH1A1KLKB1MAPTMEN1KMT2A | |
| SCHEMBL27677363 | 0.72 | PRMT5 (0.47) | ALDH1A1KLKB1MEN1KMT2ANPSR1 | |
| SCHEMBL24365636 | 0.70 | SCD (0.47) | ALDH1A1SCDSCD5TP53MAPT | |
| SCHEMBL5067868 | 0.68 | ADORA2A (0.46) | ALDH1A1MMP13TP53POLBRXFP1 | |
| SCHEMBL29477911 | 0.68 | SCD (0.42) | SCDSCD5TP53MAPTKMT2A | |
| SCHEMBL29477649 | 0.67 | SCD (0.44) | SCDSCD5TP53MAPTKMT2A | |
| SCHEMBL29324173 | 0.67 | SCD (0.44) | SCDSCD5TP53MAPTKMT2A | |
| SCHEMBL29806028 | 0.66 | KDM1A (0.49) | ALDH1A1MMP13TP53KDM4EMAPT | |
| SCHEMBL18618487 | 0.65 | MMP2 (0.43) | — | |
| SCHEMBL26501839 | 0.65 | MMP2 (0.43) | — |
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-101023083-A | Nitrogenous fused bicyclic compound | TANABE SEIYAKU CO (JP) | 2007-08-22 | — | — | CN | disclosed |