Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | WHR1 | P49842 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | GRM5 | P41594 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL17307062 | 0.95 | KDM4E (0.45) | WHR1ALDH1A1KDM4EMAPTLMNA | |
| SCHEMBL17307086 | 0.90 | WHR1 (0.42) | WHR1ALDH1A1KDM4EMAPTLMNA | |
| SCHEMBL17306699 | 0.90 | DHODH (0.43) | WHR1ALDH1A1KDM4EMAPTLMNA | |
| SCHEMBL17307080 | 0.90 | DHODH (0.43) | WHR1ALDH1A1KDM4EMAPTLMNA | |
| SCHEMBL17306754 | 0.90 | DHODH (0.43) | WHR1ALDH1A1KDM4EMAPTLMNA | |
| SCHEMBL17306478 | 0.89 | WHR1 (0.45) | WHR1ALDH1A1KDM4EMAPTLMNA | |
| SCHEMBL17307074 | 0.89 | WHR1 (0.45) | WHR1ALDH1A1KDM4EMAPTLMNA | |
| SCHEMBL17306713 | 0.88 | WHR1 (0.42) | WHR1ALDH1A1KDM4EMAPTLMNA | |
| SCHEMBL17307083 | 0.88 | DHODH (0.42) | WHR1ALDH1A1KDM4EMAPTLMNA | |
| SCHEMBL17307058 | 0.87 | WHR1 (0.47) | WHR1ALDH1A1KDM4EMAPTLMNA |
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-2015182769-A1 | QUINAZOLINE AND BENZOQUINAZOLINE COMPOUNDS AND PRODUCTION AND USE OF SAME | 東ソー株式会社 | 2015-12-03 | — | — | WO | disclosed |