Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 4/20 | 0.37 |
| ▸ | CTRC | Q99895 | 1/20 | 0.36 |
| ▸ | NOS3 | P29474 | 1/20 | 0.36 |
| ▸ | NOS1 | P29475 | 1/20 | 0.36 |
| ▸ | NOS2 | P35228 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | PTGES | O14684 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | TACR3 | P29371 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | CASP3 | P42574 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.35 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4774621 | 0.91 | DHODH (0.41) | DHODHGSK3BCTRCNOS3NOS1 | |
| SCHEMBL4781138 | 0.82 | S1PR1 (0.39) | DHODHHRH3 | |
| SCHEMBL4780548 | 0.78 | DHODH (0.39) | DHODHGSK3BCTRCNOS3NOS1 | |
| SCHEMBL4774798 | 0.78 | NOS3 (0.42) | DHODHGSK3BCTRCNOS3NOS1 | |
| SCHEMBL4848577 | 0.73 | SIGMAR1 (0.38) | NOS3NOS1NOS2KCNH2SMN1; SMN2 | |
| SCHEMBL4794392 | 0.73 | DHODH (0.36) | DHODHGSK3BNOS3NOS1NOS2 | |
| SCHEMBL4794671 | 0.72 | HTR1D (0.51) | DHODH | |
| SCHEMBL13617779 | 0.68 | RARB (0.58) | ALDH1A1KDM4EMAPT | |
| SCHEMBL13618274 | 0.68 | RARB (0.58) | ALDH1A1KDM4EMAPT | |
| Butylbenzyl SCHEMBL17458796 | 0.68 | ALDH1A1 (0.54) | KCNH2ALDH1A1HPGDHSD11B1 |
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 |