Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | PIN1 | Q13526 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5280063 | 0.87 | CYP1A2 (0.49) | ALDH1A1PIN1KMT2AMEN1NPSR1 | |
| SCHEMBL5124890 | 0.84 | KMT2A (0.64) | ALDH1A1PIN1KMT2AMEN1CYP1A2 | |
| SCHEMBL5279608 | 0.83 | ALDH1A1 (0.71) | ALDH1A1KMT2AMEN1NPSR1CYP1A2 | |
| SCHEMBL5285487 | 0.81 | ALDH1A1 (0.52) | ALDH1A1KMT2AMEN1NPSR1CYP1A2 | |
| SCHEMBL5284020 | 0.81 | ALDH1A1 (0.52) | ALDH1A1KMT2AMEN1NPSR1CYP1A2 | |
| SCHEMBL5294553 | 0.81 | ALDH1A1 (0.50) | ALDH1A1KMT2AMEN1NPSR1CYP1A2 | |
| SCHEMBL5279202 | 0.80 | KMT2A (0.73) | ALDH1A1KMT2AMEN1NPSR1CYP1A2 | |
| SCHEMBL5124969 | 0.79 | CYP1A2 (0.71) | ALDH1A1KMT2AMEN1NPSR1CYP1A2 | |
| SCHEMBL5279902 | 0.79 | KMT2A (0.49) | ALDH1A1KMT2AMEN1NPSR1CYP1A2 | |
| SCHEMBL14746303 | 0.79 | PIN1 (0.43) | ALDH1A1PIN1KMT2AMEN1MAPK14 |
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-1866289-A1 | PYRIMIDINE CARBOXYLIC ACID DERIVATIVES AND USE THEREOF | Bayer HealthCare AG (DE) | 2007-12-19 | — | — | EP | disclosed |
| WO-2006097220-A1 | PYRIMIDINE CARBOXYLIC ACID DERIVATIVES AND USE THEREOF | BAYER HEALTHCARE AG (DE) | 2006-09-21 | — | — | WO | disclosed |