Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTNNB1 | P35222 | 12/20 | 0.72 |
| ▸ | TCF7L2 | Q9NQB0 | 12/20 | 0.72 |
| ▸ | PDE5A | O76074 | 2/20 | 0.61 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.61 |
| ▸ | HTR2A | P28223 | 1/20 | 0.60 |
| ▸ | DRD3 | P35462 | 1/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.59 |
| ▸ | MAPT | P10636 | 1/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.59 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.59 |
| ▸ | GLA | P06280 | 2/20 | 0.59 |
| ▸ | TSHR | P16473 | 2/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.59 |
| ▸ | LMNA | P02545 | 1/20 | 0.59 |
| ▸ | GAA | P10253 | 1/20 | 0.59 |
| ▸ | THRB | P10828 | 1/20 | 0.59 |
| ▸ | HPGD | P15428 | 1/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.59 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL3642575 | 0.89 | CTNNB1 (0.68) | CTNNB1TCF7L2PDE5AHRH4HTR2A | |
| SCHEMBL2592377 | 0.88 | PDE5A (0.77) | CTNNB1TCF7L2PDE5AHRH4HTR2A | |
| SCHEMBL3639211 | 0.88 | PDE5A (0.77) | CTNNB1TCF7L2PDE5AHRH4HTR2A | |
| SCHEMBL3644763 | 0.87 | PDE5A (0.65) | CTNNB1TCF7L2PDE5AHRH4HTR2A | |
| SCHEMBL3643346 | 0.87 | PDE5A (0.79) | CTNNB1TCF7L2PDE5AHRH4HTR2A | |
| SCHEMBL7258161 | 0.86 | CTNNB1 (0.57) | CTNNB1TCF7L2PDE4APDE4BPDE4C | |
| SCHEMBL3641690 | 0.85 | CTNNB1 (0.76) | CTNNB1TCF7L2PDE5AHRH4HTR2A | |
| SCHEMBL3640595 | 0.85 | PDE5A (0.69) | CTNNB1TCF7L2PDE5AHRH4HTR2A | |
| SCHEMBL3644267 | 0.85 | KDM4E (0.66) | CTNNB1TCF7L2PDE5AHRH4HTR2A | |
| SCHEMBL4179551 | 0.84 | CTNNB1 (1.00) | CTNNB1TCF7L2 |
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-2003055866-A1 | QUINAZOLINE AND QUINOLINE DERIVATIVE COMPOUNDS AS INHIBITORS OF PROLYLPEPTIDASE, INDUCERS OF APOPTOSIS AND CANCER TREATMENT AGENTS | BAYER PHARMACEUTICALS CORPORATION (US) | 2003-07-10 | — | — | WO | disclosed |