Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 4/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | BRD4 | O60885 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.38 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.38 |
| ▸ | EP300 | Q09472 | 1/20 | 0.38 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | PGK1 | P00558 | 1/20 | 0.34 |
| ▸ | PGK2 | P07205 | 1/20 | 0.34 |
| ▸ | BAZ2A | Q9UIF9 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10750624 | 0.78 | HSD17B10 (0.38) | HSD17B10RAB9ANPC1CYP3A4MAPT | |
| SCHEMBL7953582 | 0.76 | CYP3A4 (0.44) | HSD17B10RAB9ANPC1CYP3A4MAPT | |
| SCHEMBL2810235 | 0.75 | CYP3A4 (0.44) | HSD17B10RAB9ANPC1CYP3A4MAPT | |
| SCHEMBL3735175 | 0.75 | CYP3A4 (0.47) | HSD17B10RAB9ANPC1CYP3A4MAPT | |
| SCHEMBL20202499 | 0.75 | HSD17B10 (0.42) | HSD17B10RAB9ANPC1CYP3A4MAPT | |
| SCHEMBL9461239 | 0.75 | PGK1 (0.36) | CYP3A4PGK1PGK2MAPK1TSHR | |
| SCHEMBL24489070 | 0.74 | PRKCI (0.40) | HSD17B10RAB9ANPC1CYP3A4MAPT | |
| SCHEMBL2046049 | 0.74 | CYP3A4 (0.52) | CYP3A4MAPTSMN1; SMN2HPGDLMNA | |
| SCHEMBL2617493 | 0.74 | HSD17B10 (0.45) | HSD17B10RAB9ANPC1CYP3A4MAPT | |
| SCHEMBL10455860 | 0.72 | CYP3A4 (0.42) | HSD17B10CYP3A4MAPTSMN1; SMN2HPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016012930-A1 | ISOINDOLINONE DERIVATIVES USEFUL AS ANTIVIRAL AGENTS | VIIV HEALTHCARE UK LIMITED (GB) | 2016-01-28 | — | — | WO | disclosed |