Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 4/20 | 0.63 |
| ▸ | NPY5R | Q15761 | 5/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | ACP1 | P24666 | 1/20 | 0.49 |
| ▸ | PDE5A | O76074 | 2/20 | 0.49 |
| ▸ | KDM1A | O60341 | 2/20 | 0.49 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.49 |
| ▸ | SOS1 | Q07889 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8888779 | 0.99 | EGFR (0.62) | EGFRNPY5RMEN1KMT2AKDM4E | |
| SCHEMBL8893267 | 0.90 | NPY5R (0.60) | EGFRNPY5RKDM1ANPC1PKM | |
| Hydrochloric Acid SCHEMBL8909035 | 0.89 | NPY5R (0.59) | EGFRNPY5RKDM1ANPC1PKM | |
| SCHEMBL8889656 | 0.87 | EGFR (0.54) | EGFRMEN1KMT2AKDM4ECYP1A2 | |
| SCHEMBL2590759 | 0.82 | NPY5R (0.76) | EGFRNPY5RMEN1KMT2AKDM4E | |
| SCHEMBL8901496 | 0.82 | NPY5R (0.68) | NPY5RKDM1AABCG2NPC1PKM | |
| Hydrochloric Acid SCHEMBL8913197 | 0.81 | NPY5R (0.67) | NPY5RPOLBKDM1AABCG2NPC1 | |
| SCHEMBL2587936 | 0.79 | NPY5R (0.84) | EGFRNPY5RMEN1KMT2AKDM4E | |
| SCHEMBL2592190 | 0.79 | NPY5R (0.78) | EGFRNPY5RMEN1KMT2AKDM4E | |
| SCHEMBL8908702 | 0.77 | NPY5R (0.74) | NPY5RKDM1ANPC1PKMRAB9A |
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-1997020822-A1 | QUINAZOLIN-2,4-DIAZIRINES AS NPY RECEPTOR ANTAGONIST | NOVARTIS AG (CH) | 1997-06-12 | — | — | WO | claimed |