Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | UHRF1 | Q96T88 | 1/20 | 0.42 |
| ▸ | CCR1 | P32246 | 1/20 | 0.42 |
| ▸ | CCR5 | P51681 | 1/20 | 0.42 |
| ▸ | CCR8 | P51685 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 4/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 4/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.41 |
| ▸ | ADRA1B | P35368 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | NOS1 | P29475 | 3/20 | 0.39 |
| ▸ | NOS2 | P35228 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | NOS3 | P29474 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.37 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL10858865 | 0.88 | UHRF1 (0.48) | UHRF1CCR1CCR5CCR8HTR1A | |
| SCHEMBL28142250 | 0.85 | KCNH2 (0.48) | UHRF1CCR1CCR5CCR8HTR1A | |
| SCHEMBL27655489 | 0.85 | KCNH2 (0.48) | UHRF1CCR1CCR5CCR8HTR1A | |
| SCHEMBL28183218 | 0.85 | KCNH2 (0.48) | UHRF1CCR1CCR5CCR8HTR1A | |
| SCHEMBL2547957 | 0.85 | KCNH2 (0.48) | UHRF1CCR1CCR5CCR8HTR1A | |
| SCHEMBL2551597 | 0.85 | KCNH2 (0.48) | UHRF1CCR1CCR5CCR8HTR1A | |
| SCHEMBL28878273 | 0.85 | KCNH2 (0.48) | UHRF1CCR1CCR5CCR8HTR1A | |
| SCHEMBL28142976 | 0.85 | KCNH2 (0.48) | UHRF1CCR1CCR5CCR8HTR1A | |
| SCHEMBL27876575 | 0.85 | KCNH2 (0.48) | UHRF1CCR1CCR5CCR8HTR1A | |
| Hydrochloric Acid SCHEMBL11412762 | 0.84 | UHRF1 (0.48) | UHRF1CCR1CCR5CCR8HTR1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0824524-A1 | ALPHA-SUBSTITUTED PYRIMIDINE-THIOALKYL AND ALKYLETHER COMPOUNDS AS INHIBITORS OF VIRAL REVERSE TRANSCRIPTASE | PHARMACIA & UPJOHN COMPANY (US) | 1998-02-25 | — | — | EP | disclosed |