Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 6/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 6/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | DHODH | Q02127 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | NOS3 | P29474 | 1/20 | 0.31 |
| ▸ | NOS1 | P29475 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 1/20 | 0.31 |
| ▸ | TACR3 | P29371 | 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 | |
|---|---|---|---|---|
| SCHEMBL4774798 | 0.80 | NOS3 (0.42) | ALDH1A1HPGDHSD17B10MEN1MAPT | |
| SCHEMBL4774621 | 0.76 | DHODH (0.41) | ALDH1A1HPGDMAPTDHODHNOS3 | |
| SCHEMBL4794671 | 0.75 | HTR1D (0.51) | CYP2D6CYP1A2DHODH | |
| SCHEMBL4794392 | 0.74 | DHODH (0.36) | DHODHHTR2ANOS3NOS1NOS2 | |
| SCHEMBL4780548 | 0.74 | DHODH (0.39) | ALDH1A1HPGDDHODHNOS3NOS1 | |
| SCHEMBL4796492 | 0.70 | TAAR1 (0.42) | DHODHNOS3NOS1NOS2TACR3 | |
| SCHEMBL4795959 | 0.68 | ADRA2A (0.39) | — | |
| SCHEMBL4780934 | 0.68 | DHODH (0.40) | ALDH1A1HPGDMAPTDHODHNOS3 | |
| SCHEMBL4795346 | 0.66 | CTSK (0.41) | NPSR1DHODH | |
| SCHEMBL4791758 | 0.66 | SREBF2 (0.36) | DHODH |
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-2008009963-A2 | PYRIMIDINE DERIVATIVES AS MODULATORS OF PARATHYROID HORMONE RECEPTORS | JAMES BLACK FOUNDATION LIMITED (GB) | 2008-01-24 | — | — | WO | disclosed |