Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.60 |
| ▸ | RPS6KA2 | Q15349 | 8/20 | 0.53 |
| ▸ | BCHE | P06276 | 2/20 | 0.50 |
| ▸ | CES1 | P23141 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9432418 | 0.86 | MAPK1 (0.54) | MAPK1RPS6KA2BCHECES1HSD17B10 | |
| SCHEMBL9848755 | 0.85 | MAPK1 (0.56) | MAPK1RPS6KA2BCHECES1HSD17B10 | |
| SCHEMBL9848765 | 0.83 | MAPK1 (0.51) | MAPK1RPS6KA2BCHECES1HSD17B10 | |
| SCHEMBL9431501 | 0.82 | MAPK1 (0.50) | MAPK1RPS6KA2BCHECES1HSD17B10 | |
| SCHEMBL9848744 | 0.78 | MAPK1 (0.51) | MAPK1RPS6KA2BCHECES1HSD17B10 | |
| SCHEMBL9304609 | 0.67 | RPS6KA2 (0.77) | MAPK1RPS6KA2BCHECES1HSD17B10 | |
| SCHEMBL19818182 | 0.66 | RPS6KA2 (0.59) | MAPK1RPS6KA2KDM4EALDH1A1MAPT | |
| SCHEMBL30501207 | 0.66 | RPS6KA2 (0.59) | MAPK1RPS6KA2KDM4EALDH1A1MAPT | |
| SCHEMBL9848757 | 0.66 | KMT2A (0.36) | HSD17B10MEN1KMT2AHPGDKDM4E | |
| SCHEMBL600199 | 0.64 | NPSR1 (0.55) | HSD17B10MEN1KMT2AHPGDALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0462808-A2 | Inhibitors of HIV reverse transcriptase | MERCK & CO. INC. (US) | 1991-12-27 | — | — | EP | claimed |
| EP-0462808-A2 | Inhibitors of HIV reverse transcriptase | MERCK & CO. INC. (US) | 1991-12-27 | — | — | EP | disclosed |