Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.52 |
| ▸ | TSHR | P16473 | 3/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | HPGD | P15428 | 3/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.47 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.46 |
| ▸ | CDK1 | P06493 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL10978267 | 0.91 | MAPK1 (0.48) | ALDH1A1TSHRMAPK1NPSR1MAPT | |
| SCHEMBL10985200 | 0.90 | MAPK1 (0.47) | ALDH1A1TSHRMAPK1NPSR1MAPT | |
| SCHEMBL10977478 | 0.89 | LMNA (0.58) | ALDH1A1TSHRMAPK1NPSR1KMT2A | |
| SCHEMBL11286741 | 0.83 | ALDH1A1 (0.53) | ALDH1A1TSHRMAPK1MAPTTHRB | |
| SCHEMBL3977245 | 0.82 | ALDH1A1 (0.53) | ALDH1A1TSHRMAPK1MAPTTHRB | |
| SCHEMBL10532456 | 0.81 | TOP2A (0.52) | ALDH1A1TSHRMAPK1NPSR1KMT2A | |
| SCHEMBL11859664 | 0.80 | CSNK1D (0.53) | ALDH1A1TSHRMAPK1NPSR1MAPT | |
| SCHEMBL10413352 | 0.79 | KMT2A (0.58) | ALDH1A1TSHRMAPK1MAPTTHRB | |
| SCHEMBL11283380 | 0.79 | ALDH1A1 (0.51) | ALDH1A1TSHRMAPK1MAPTTHRB | |
| SCHEMBL8941946 | 0.79 | ALDH1A1 (0.55) | ALDH1A1TSHRMAPK1MAPTTHRB |
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-4497816-A | 7-(4-Pyridyl)-1,8-naphthyridine derivatives and their antibacterial compositions | DAINIPPON PHARMACEUTICAL CO., LTD. (JP) | 1985-02-05 | — | — | US | disclosed |