Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K4 | O95819 | 4/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | CASP1 | P29466 | 1/20 | 0.55 |
| ▸ | RECQL | P46063 | 1/20 | 0.55 |
| ▸ | NOS3 | P29474 | 1/20 | 0.43 |
| ▸ | NOS2 | P35228 | 1/20 | 0.43 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.40 |
| ▸ | HBB | P68871 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.39 |
| ▸ | AXL | P30530 | 1/20 | 0.39 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.39 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL34048 | 0.85 | — | — | |
| SCHEMBL29353771 | 0.85 | — | — | |
| SCHEMBL28007341 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL30136813 | 0.83 | NOS3 (0.52) | MAP4K4NOS3NOS2MEN1KDM4E | |
| Hydrochloric Acid SCHEMBL913230 | 0.83 | NOS3 (0.52) | MAP4K4NOS3NOS2MEN1KDM4E | |
| Hydrochloric Acid SCHEMBL7654260 | 0.83 | — | — | |
| Iodomethane SCHEMBL28605886 | 0.78 | NOS3 (0.54) | MAP4K4NOS3NOS2KDM4EHSD17B10 | |
| 2-Aminopyridine SCHEMBL6669260 | 0.76 | NOS3 (0.70) | MAP4K4CASP1NOS3NOS2PDPK1 | |
| Pyrrole SCHEMBL28142812 | 0.76 | NOS3 (0.41) | MAP4K4NOS3NOS2PDPK1MEN1 | |
| Pyrimidine SCHEMBL11055821 | 0.76 | HSP90AA1 (0.48) | MAP4K4CYP3A4NOS3NOS2PDPK1 |
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-0857477-B1 | Hair dye | GOLDWELL GMBH (DE) | 1999-07-21 | — | — | EP | disclosed |
| EP-0857477-A1 | Hair dye | GOLDWELL GmbH (DE) | 1998-08-12 | — | — | EP | disclosed |