Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.51 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.51 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.51 |
| ▸ | HTR2A | P28223 | 1/20 | 0.51 |
| ▸ | SCN1A | P35498 | 1/20 | 0.51 |
| ▸ | HTR2B | P41595 | 1/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.51 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.51 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | AVPR1B | P47901 | 4/20 | 0.49 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL31061228 | 1.00 | ALDH1A1 (0.51) | ALDH1A1HRH3MAPK1SIGMAR1CYP1A2 | |
| SCHEMBL2502393 | 0.81 | ALDH1A1 (0.54) | ALDH1A1HRH3MAPK1SIGMAR1CYP1A2 | |
| SCHEMBL27076566 | 0.81 | HRH3 (0.54) | HRH3KCNH2 | |
| SCHEMBL239668 | 0.81 | SIGMAR1 (0.56) | ALDH1A1HRH3MAPK1SIGMAR1CYP1A2 | |
| SCHEMBL16245396 | 0.79 | HRH3 (0.54) | ALDH1A1HRH3MAPK1SIGMAR1CYP1A2 | |
| SCHEMBL3399864 | 0.78 | KDM4E (0.53) | ALDH1A1MAPK1KCNH2TSHRNPSR1 | |
| SCHEMBL12474212 | 0.77 | EGFR (0.64) | HRH3KCNH2SRC | |
| SCHEMBL28959188 | 0.76 | RAF1 (0.48) | MAPK1AVPR1BSRC | |
| SCHEMBL30017088 | 0.75 | RAF1 (0.51) | MAPK1AVPR1BSRC | |
| SCHEMBL28959219 | 0.75 | RAF1 (0.51) | MAPK1AVPR1BSRC |
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-2009090661-A9 | 6.7-DIALKOXY OUINAZOLINE DERIVATIVES USEFUL FOR TREATMENT OF CANCER RELATED DISORDERS | NATCO PHARMA LIMITED (IN) | 2010-06-17 | — | — | WO | disclosed |