Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | FOS | P01100 | 3/20 | 0.36 |
| ▸ | JUN | P05412 | 3/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.36 |
| ▸ | RELA | Q04206 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | CUL4A | Q13619 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5278083 | 0.87 | ALDH1A1 (0.39) | ALDH1A1KDM4ESMN1; SMN2MAPTLMNA | |
| SCHEMBL5292147 | 0.84 | CYP11B2 (0.41) | ALDH1A1KDM4EMAPTKCNQ3KCNQ2 | |
| SCHEMBL5280720 | 0.83 | PDGFRB (0.42) | ALDH1A1KDM4EATMCYP1A2CYP2C9 | |
| SCHEMBL5119467 | 0.83 | ALDH1A1 (0.57) | ALDH1A1KDM4ESMN1; SMN2MAPTLMNA | |
| SCHEMBL5283873 | 0.82 | MAPT (0.47) | ALDH1A1SMN1; SMN2MAPTLMNAMAPK1 | |
| SCHEMBL5279567 | 0.81 | ALDH1A1 (0.56) | ALDH1A1KDM4ESMN1; SMN2MAPTLMNA | |
| SCHEMBL5281269 | 0.81 | ALDH1A1 (0.41) | ALDH1A1KDM4ESMN1; SMN2MAPTLMNA | |
| SCHEMBL5278782 | 0.80 | CYP1A2 (0.42) | ALDH1A1KDM4ESMN1; SMN2MAPTLMNA | |
| SCHEMBL5293508 | 0.80 | ALDH1A1 (0.54) | ALDH1A1KDM4ESMN1; SMN2MAPTLMNA | |
| SCHEMBL5299485 | 0.75 | PDGFRB (0.38) | ALDH1A1SMN1; SMN2MAPTLMNAMAPK1 |
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 |