Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPY1R | P25929 | 10/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
| ▸ | USP2 | O75604 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.36 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.36 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | CASP1 | P29466 | 1/20 | 0.31 |
| ▸ | KLK7 | P49862 | 1/20 | 0.31 |
| ▸ | CASP7 | P55210 | 1/20 | 0.31 |
| ▸ | PTH1R | Q03431 | 1/20 | 0.31 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.31 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7602720 | 0.80 | NPY1R (0.67) | NPY1RALDH1A1HPGDHSD17B10USP2 | |
| SCHEMBL7674802 | 0.80 | NPY1R (0.84) | NPY1RALDH1A1HPGDHSD17B10USP2 | |
| Hydrochloric Acid SCHEMBL7039372 | 0.73 | NPY1R (0.80) | NPY1RALDH1A1HPGDHSD17B10USP2 | |
| SCHEMBL7041652 | 0.72 | NPY1R (0.79) | NPY1RALDH1A1HPGDHSD17B10USP2 | |
| SCHEMBL7042465 | 0.71 | NPY1R (1.00) | NPY1RALDH1A1HPGDHSD17B10USP2 | |
| SCHEMBL7044646 | 0.71 | NPY1R (1.00) | NPY1RALDH1A1HPGDHSD17B10USP2 | |
| SCHEMBL1594161 | 0.70 | NPY1R (0.64) | NPY1RALDH1A1HPGDHSD17B10USP2 | |
| Bromide SCHEMBL7042704 | 0.70 | NPY1R (0.80) | NPY1RALDH1A1HPGDHSD17B10USP2 | |
| SCHEMBL7045687 | 0.69 | NPY1R (1.00) | NPY1RALDH1A1HPGDHSD17B10USP2 | |
| SCHEMBL7042466 | 0.69 | NPY1R (0.83) | NPY1RALDH1A1HPGDHSD17B10USP2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1218379-A2 | CERTAIN ALKYLENE DIAMINE-SUBSTITUTED PYRAZOLO 1,5,-a]-1,5-PYRIMIDINES AND PYRAZOLO 1,5-a]-1,3,5-TRIAZINES | NEUROGEN CORPORATION (US) | 2002-07-03 | — | — | EP | claimed |
| WO-2001023387-A2 | CERTAIN ALKYLENE DIAMINE-SUBSTITUTED PYRAZOLO[1,5,-a]-1,5-PYRIMIDINES AND PYRAZOLO[1,5-a]-1,3,5-TRIAZINES | NEUROGEN CORPORATION (US) | 2001-04-05 | — | — | WO | claimed |