Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 8/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 8/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.37 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.37 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL22590994 | 0.91 | TP53 (0.46) | ALDH1A1HPGDMEN1KMT2AL3MBTL1 | |
| SCHEMBL19783897 | 0.87 | MEN1 (0.47) | ALDH1A1MEN1KMT2AL3MBTL1TSHR | |
| SCHEMBL21220029 | 0.76 | ALDH1A1 (0.52) | ALDH1A1MEN1KMT2AL3MBTL1MAPT | |
| SCHEMBL1642202 | 0.76 | ALDH1A1 (0.52) | ALDH1A1MEN1KMT2AL3MBTL1MAPT | |
| SCHEMBL28295623 | 0.74 | MEN1 (0.51) | ALDH1A1HPGDMEN1KMT2AL3MBTL1 | |
| SCHEMBL20969294 | 0.70 | MEN1 (0.56) | HPGDMEN1KMT2A | |
| SCHEMBL3651432 | 0.70 | MEN1 (0.56) | HPGDMEN1KMT2A | |
| SCHEMBL5655931 | 0.67 | KMT2A (0.56) | ALDH1A1HPGDMEN1KMT2AL3MBTL1 | |
| SCHEMBL12492396 | 0.67 | KMT2A (0.56) | ALDH1A1HPGDMEN1KMT2AL3MBTL1 | |
| SCHEMBL5655937 | 0.67 | KMT2A (0.56) | ALDH1A1HPGDMEN1KMT2AL3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018011017-A1 | 7-SUBSTITUTED 1-PYRIDYL-NAPHTHYRIDINE-3-CARBOXYLIC ACID AMIDES AND USE THEREOF | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2018-01-18 | — | — | WO | disclosed |