Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PYCR1 | P32322 | 6/20 | 0.41 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | MEP1B | Q16820 | 2/20 | 0.31 |
| ▸ | MEP1A | Q16819 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL902072 | 0.72 | PYCR1 (0.38) | PYCR1CHRNB2CHRNA4KDM4EALDH1A1 | |
| SCHEMBL12643383 | 0.72 | RIPK1 (0.53) | PYCR1RIPK1KDM4EALDH1A1 | |
| SCHEMBL12124983 | 0.71 | KDM4E (0.57) | RIPK1KDM4EALDH1A1 | |
| SCHEMBL24136880 | 0.69 | TYR (0.41) | RIPK1CHRNB2CHRNA4 | |
| SCHEMBL6489433 | 0.67 | GPR84 (0.35) | RIPK1MEP1BMEP1A | |
| SCHEMBL6226217 | 0.67 | PYCR1 (0.62) | PYCR1CHRNB2CHRNA4KDM4EALDH1A1 | |
| SCHEMBL19859261 | 0.67 | PRKCE (0.34) | KDM4EALDH1A1MEP1B | |
| SCHEMBL18611210 | 0.66 | GABRA1 (0.44) | RIPK1MEP1BMEP1A | |
| SCHEMBL23374698 | 0.65 | RIPK1 (0.47) | PYCR1RIPK1CHRNB2CHRNA4KDM4E | |
| SCHEMBL313506 | 0.65 | CES2 (0.36) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2621919-A1 | PHENYLQUINAZOLINE DERIVATIVES | Merck Patent GmbH (DE) | 2013-08-07 | — | — | EP | disclosed |
| WO-2012041435-A1 | PHENYLQUINAZOLINE DERIVATIVES | MERCK PATENT GMBH (DE) | 2012-04-05 | — | — | WO | disclosed |