Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 9/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 9/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.50 |
| ▸ | USP2 | O75604 | 4/20 | 0.50 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.50 |
| ▸ | PDE5A | O76074 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | LDHA | P00338 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 4/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL8889084 | 0.94 | CASP6 (0.50) | CYP1A2CYP3A4HSD17B10USP2CLK4 | |
| SCHEMBL8898278 | 0.88 | SOS1 (0.52) | PDE5AKDM4EALDH1A1KMT2ALMNA | |
| SCHEMBL8898351 | 0.87 | VCP (0.48) | CYP1A2CYP3A4HSD17B10USP2CLK4 | |
| SCHEMBL8901747 | 0.85 | TAAR1 (0.56) | USP2KDM4EALDH1A1MAPK1TSHR | |
| SCHEMBL8898947 | 0.85 | TLR9 (0.51) | PDE5AALDH1A1MAPK1APPCASP6 | |
| SCHEMBL8889922 | 0.84 | NPY5R (0.49) | PDE5AALDH1A1MAPTHPGDTDP1 | |
| SCHEMBL13796628 | 0.84 | NPY5R (0.55) | CYP1A2CYP3A4HSD17B10USP2CLK4 | |
| SCHEMBL8898707 | 0.83 | FLT3 (0.48) | APPCASP6TLR7SOS1TRIM58 | |
| SCHEMBL8907323 | 0.83 | TRIM58 (0.57) | ALDH1A1MAPK1KMT2ACASP6TRIM58 | |
| SCHEMBL8899155 | 0.83 | TRIM58 (0.57) | ALDH1A1MAPK1KMT2ACASP6TRIM58 |
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-1997020823-A2 | 2-AMINO QUINAZOLINE DERIVATIVES AS NPY RECEPTOR ANTAGONISTS | NOVARTIS AG (CH) | 1997-06-12 | — | — | WO | disclosed |