Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.38 |
| ▸ | CCR4 | P51679 | 2/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.37 |
| ▸ | TNF | P01375 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.37 |
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 SCHEMBL8920462 | 0.99 | KDM1A (0.42) | KDM1AMEN1NPC1KMT2AALK | |
| SCHEMBL8890559 | 0.83 | KDR (0.38) | KDM1AMEN1NPC1KMT2AALK | |
| SCHEMBL8898287 | 0.74 | HTR2A (0.41) | KDM1AALKCCR4HTR2ANPY5R | |
| SCHEMBL8898291 | 0.74 | CCR4 (0.38) | CCR4HTR2ANPY5R | |
| Hydrochloric Acid SCHEMBL8892373 | 0.73 | EGFR (0.49) | KDM1ATNFALDH1A1 | |
| SCHEMBL6039162 | 0.71 | KDM1A (0.48) | KDM1ANPY5RUSP2ALDH1A1LMNA | |
| SCHEMBL8890323 | 0.69 | NPY5R (0.45) | NPY5RTNF | |
| SCHEMBL9214074 | 0.69 | EGFR (0.64) | MEN1NPC1KMT2ATNFALDH1A1 | |
| Hydrochloric Acid SCHEMBL8890553 | 0.68 | NPY5R (0.44) | NPY5RTNF | |
| SCHEMBL8889981 | 0.67 | MERTK (0.48) | KDM1ANPY5RUSP2 |
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 |