Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 2/20 | 0.41 |
| ▸ | CCR8 | P51685 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | ALPL | P05186 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | ALPI | P09923 | 1/20 | 0.33 |
| ▸ | ALPG | P10696 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | CCR5 | P51681 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL12299266 | 0.80 | CCR1 (0.44) | CCR1CCR8TP53KDM4EALOX15 | |
| SCHEMBL17658982 | 0.80 | IRAK4 (0.33) | IRAK4POLB | |
| SCHEMBL11390908 | 0.79 | KCNH2 (0.37) | CCR1CCR8LMNANOS1NOS2 | |
| SCHEMBL24713780 | 0.78 | IRAK4 (0.43) | IRAK4POLB | |
| SCHEMBL9877610 | 0.78 | NOS2 (0.45) | KDM4ENOS1NOS2MAPTIDH1 | |
| SCHEMBL13178690 | 0.78 | NOS1 (0.37) | NOS1NOS2 | |
| SCHEMBL18557494 | 0.78 | L3MBTL1 (0.42) | SMN1; SMN2L3MBTL1MAPTMEN1KMT2A | |
| SCHEMBL18704859 | 0.75 | CYP3A4 (0.40) | IRAK4IDH1BTK | |
| SCHEMBL12922238 | 0.73 | CCR1 (0.46) | CCR1CCR8TP53KDM4ELMNA | |
| SCHEMBL21024617 | 0.72 | KCNH2 (0.35) | L3MBTL1NOS1NOS2MEN1KMT2A |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5003069-A | Chichibabin reaction | REILLY INDUSTRIES, INC. (US) | 1991-03-26 | — | — | US | disclosed |
| EP-0098684-A2 | Modified chichibabin reaction, and novel pyridine derivatives | REILLY INDUSTRIES, INC. (US) | 1984-01-18 | — | — | EP | disclosed |
| US-4267335-A | Substituted 2,2'-bipyridyl compounds and process for preparing same | REILLY TAR & CHEMICAL CORPORATION (US) | 1981-05-12 | — | — | US | disclosed |
| US-4267335-A | Substituted 2,2'-bipyridyl compounds and process for preparing same | REILLY TAR & CHEMICAL CORPORATION (US) | 1981-05-12 | — | — | US | disclosed |
| US-4177349-A | BY-PRODUCT INHIBITION | REILLY TAR & CHEMICAL CORPORATION (US) | 1979-12-04 | — | — | US | disclosed |
| US-4177349-A | BY-PRODUCT INHIBITION | REILLY TAR & CHEMICAL CORPORATION (US) | 1979-12-04 | — | — | US | disclosed |