Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 2/20 | 0.50 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.36 |
| ▸ | HTR2A | P28223 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | MIF | P14174 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.32 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.32 |
| ▸ | CTRC | Q99895 | 1/20 | 0.32 |
| ▸ | FLT1 | P17948 | 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 | |
|---|---|---|---|---|
| SCHEMBL14008752 | 0.86 | GABRA1 (0.50) | GABRA1GABRB2ALDH1A1LMNAKCNH2 | |
| SCHEMBL27514598 | 0.82 | CYP2A6 (0.38) | GABRA1GABRB2ALDH1A1LMNASLC6A4 | |
| SCHEMBL9840366 | 0.80 | GABRA1 (0.47) | GABRA1GABRB2ALDH1A1LMNASLC6A4 | |
| SCHEMBL1021320 | 0.76 | ALDH1A1 (0.46) | GABRA1GABRB2ALDH1A1LMNASLC6A4 | |
| SCHEMBL30157452 | 0.76 | ALDH1A1 (0.46) | GABRA1GABRB2ALDH1A1LMNASLC6A4 | |
| SCHEMBL1020285 | 0.75 | TP53 (0.42) | ALDH1A1SLC6A4MAPK1IDO1MIF | |
| SCHEMBL1021879 | 0.73 | HTR2B (0.34) | GABRA1GABRB2ALDH1A1SLC6A4HTR2A | |
| SCHEMBL945820 | 0.73 | GABRA1 (0.62) | GABRA1GABRB2ALDH1A1LMNASLC6A4 | |
| SCHEMBL1457266 | 0.72 | ALDH1A1 (0.42) | GABRA1GABRB2ALDH1A1LMNASLC6A4 | |
| Water SCHEMBL28824559 | 0.72 | GABRA1 (0.60) | GABRA1GABRB2ALDH1A1LMNASLC6A4 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0540143-B1 | Compounds and methods for inhibition of HIV and related viruses | MEDIVIR AB (SE) | 2003-02-05 | — | — | EP | disclosed |
| US-5714503-A | Compounds and methods for inhibition of HIV and related viruses | MEDIVIR AB (SE) | 1998-02-03 | — | — | US | disclosed |
| US-5658907-A | THIOUREA VIRICIDES | MEDIVIR A/B (SE) | 1997-08-19 | — | — | US | disclosed |
| US-5593993-A | VIRICIDES FOR HTLV TREATMENT OF AIDS | MEDIVIR AB (SE) | 1997-01-14 | — | — | US | disclosed |
| EP-0540143-A2 | Compounds and methods for inhibition of HIV and related viruses | Medivir Aktiebolag (SE) | 1993-05-05 | — | — | EP | disclosed |