Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 8/20 | 0.39 |
| ▸ | RORC | P51449 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | PSIP1 | O75475 | 2/20 | 0.36 |
| ▸ | CCL2 | P13500 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 3/20 | 0.33 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.33 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11286859 | 0.79 | NPC1 (0.33) | RORCGAA | |
| SCHEMBL11286241 | 0.77 | SLC6A2 (0.34) | TSHR | |
| SCHEMBL11287270 | 0.75 | SLC6A4 (0.34) | — | |
| SCHEMBL11275552 | 0.75 | NQO1 (0.41) | RORCTSHR | |
| SCHEMBL11287930 | 0.75 | MAOB (0.35) | GAA | |
| SCHEMBL11277816 | 0.75 | SRD5A1 (0.44) | — | |
| SCHEMBL11282764 | 0.75 | BRD4 (0.46) | BRD4TSHR | |
| SCHEMBL11083192 | 0.75 | BRD4 (0.48) | BRD4RORCGAAPSIP1 | |
| SCHEMBL11287661 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL10674686 | 0.73 | BRD4 (0.42) | BRD4GAA |
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 |
|---|---|---|---|---|---|---|---|
| US-4322421-A | 4-Phenyl-and 5-phenyl-1,4,5,6-tetrahydro-pyrimidine derivatives | SYNTEX (U.S.A.) INC. (US) | 1982-03-30 | — | — | US | disclosed |
| US-4261995-A | DISORDERS OF CENTRAL NERVOUS SYSTEM AND CARDIOVASCULAR SYSTEM; HYPOTENSIVE | SYNTEX (U.S.A.) INC. (US) | 1981-04-14 | — | — | US | disclosed |