Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP6 | P55212 | 1/20 | 0.39 |
| ▸ | PTPN22 | Q9Y2R2 | 1/20 | 0.36 |
| ▸ | TRPM4 | Q8TD43 | 1/20 | 0.36 |
| ▸ | NQO2 | P16083 | 1/20 | 0.35 |
| ▸ | NQO1 | P15559 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | ERN1 | O75460 | 1/20 | 0.33 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | LDHA | P00338 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | MPI | P34949 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL11621353 | 0.75 | TRPM4 (0.43) | CASP6PTPN22TRPM4NQO2NQO1 | |
| SCHEMBL482745 | 0.74 | CASP6 (0.46) | CASP6PTPN22TRPM4NQO2NQO1 | |
| SCHEMBL1683810 | 0.73 | ALDH1A1 (0.50) | ALDH1A1HPGDHSD17B10 | |
| SCHEMBL1149420 | 0.73 | ALDH1A1 (0.50) | ALDH1A1HPGDHSD17B10 | |
| SCHEMBL19203288 | 0.73 | GABRA1 (0.45) | CASP6PTPN22TRPM4NQO2HPGD | |
| SCHEMBL1773408 | 0.70 | IDO1 (0.48) | LDHAMAPTHPGDHSD17B10 | |
| SCHEMBL3801017 | 0.69 | ALDH1A1 (0.38) | PTPN22RCE1ALDH1A1KDM4EMAPT | |
| SCHEMBL666673 | 0.69 | DPP4 (0.33) | ALDH1A1 | |
| SCHEMBL89098 | 0.69 | GABRA1 (0.46) | ALDH1A1KDM4EMEN1MAPTHPGD | |
| SCHEMBL11622368 | 0.68 | PTPN22 (0.46) | PTPN22ERN1ALDH1A1KDM4EMEN1 |
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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1992016180-A2 | DETECTION OF 3'-AZIDO-3'-DEOXYTHYMIDINE RESISTANCE | SISKA DIAGNOSTICS, INC. (US) | 1992-10-01 | — | — | WO | disclosed |
| EP-0393256-A1 | Aminoalkyl naphthalenediols as host resistance enhancers against viral infection | MERCK & CO. INC. (US) | 1990-10-24 | — | — | EP | disclosed |
| EP-0393256-A1 | Aminoalkyl naphthalenediols as host resistance enhancers against viral infection | MERCK & CO. INC. (US) | 1990-10-24 | — | — | EP | disclosed |
| EP-0393256-A1 | Aminoalkyl naphthalenediols as host resistance enhancers against viral infection | MERCK & CO. INC. (US) | 1990-10-24 | — | — | EP | disclosed |
| US-4925831-A | TREATING OPPORTUNISTIC INFECTIONS IN IMMUNOCOMPROMISED HOSTS | MERCK & CO., INC. (US) | 1990-05-15 | — | — | US | disclosed |
| US-4925831-A | TREATING OPPORTUNISTIC INFECTIONS IN IMMUNOCOMPROMISED HOSTS | MERCK & CO., INC. (US) | 1990-05-15 | — | — | US | disclosed |
| US-4925831-A | TREATING OPPORTUNISTIC INFECTIONS IN IMMUNOCOMPROMISED HOSTS | MERCK & CO., INC. (US) | 1990-05-15 | — | — | US | disclosed |
| US-4923852-A | Aminoalkyl naphthalenediols as host resistance enhancers against viral infections | MERCK & CO., INC. (US) | 1990-05-08 | — | — | US | disclosed |
| US-4923852-A | Aminoalkyl naphthalenediols as host resistance enhancers against viral infections | MERCK & CO., INC. (US) | 1990-05-08 | — | — | US | disclosed |
| US-4923852-A | Aminoalkyl naphthalenediols as host resistance enhancers against viral infections | MERCK & CO., INC. (US) | 1990-05-08 | — | — | US | disclosed |
| US-4894392-A | BACTERICIDES, FUNGICIDES, INFECTIONS | MERCK & CO., INC. (US) | 1990-01-16 | — | — | US | disclosed |
| US-4894392-A | BACTERICIDES, FUNGICIDES, INFECTIONS | MERCK & CO., INC. (US) | 1990-01-16 | — | — | US | disclosed |
| US-4894392-A | BACTERICIDES, FUNGICIDES, INFECTIONS | MERCK & CO., INC. (US) | 1990-01-16 | — | — | US | disclosed |
| US-4835177-A | Aminoalkyl naphthalenediols as host resistance enhancers against viral infection | MERCK & CO., INC. (US) | 1989-05-30 | — | — | US | disclosed |
| US-4835177-A | Aminoalkyl naphthalenediols as host resistance enhancers against viral infection | MERCK & CO., INC. (US) | 1989-05-30 | — | — | US | disclosed |
| US-4835177-A | Aminoalkyl naphthalenediols as host resistance enhancers against viral infection | MERCK & CO., INC. (US) | 1989-05-30 | — | — | US | disclosed |