Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP1 | O94782 | 1/20 | 0.59 |
| ▸ | WDR48 | Q8TAF3 | 1/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 10/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 10/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 10/20 | 0.52 |
| ▸ | TSHR | P16473 | 9/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 9/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 5/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 6/20 | 0.47 |
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | CLK4 | Q9HAZ1 | 4/20 | 0.47 |
| ▸ | USP2 | O75604 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL6215295 | 0.83 | SMN1; SMN2 (0.55) | USP1WDR48SMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL7260597 | 0.77 | PDE5A (0.55) | USP1WDR48CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL23518886 | 0.76 | SMN1; SMN2 (0.51) | USP1WDR48SMN1; SMN2CYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL31220566 | 0.76 | SMN1; SMN2 (0.50) | USP1WDR48SMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL7257434 | 0.75 | SMN1; SMN2 (0.55) | SMN1; SMN2TSHRALDH1A1MAPK1ALOX15 | |
| SCHEMBL22866338 | 0.74 | PDE2A (0.52) | USP1WDR48ALDH1A1HSD17B10KDM4E | |
| SCHEMBL15533833 | 0.73 | PDE4A (0.44) | ALDH1A1KMT2ACLK4RAB9AKDM4E | |
| SCHEMBL7260433 | 0.73 | PIP4K2C (0.59) | SMN1; SMN2CYP1A2CYP3A4TSHRCYP2C19 | |
| SCHEMBL7071470 | 0.73 | USP1 (0.51) | USP1WDR48CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL21686876 | 0.73 | SMN1; SMN2 (0.53) | SMN1; SMN2CYP1A2CYP3A4CYP2D6TSHR |
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-2003040141-A1 | OXAZOLYL-PHENYL-2,4-DIAMINO-PYRIMIDINE COMPOUNDS AND METHODS FOR TREATING HYPERPROLIFERATIVE DISORDERS | BAYER PHARMACEUTICALS CORPORATION (US) | 2003-05-15 | — | — | WO | disclosed |